accessibility menu, dialog, popup

UserName

Anilides

Organic compounds that are acyl derivatives of aniline; acyl groups contain a double-bonded oxygen atom and an alkyl group. These compounds are also known as phenylamides.
Quantity 
  • (16)
  • (1)
  • (3)
  • (3)
  • (15)
  • (2)
  • (1)
  • (1)
  • (2)
  • (56)
  • (2)
  • (3)
  • (27)
  • (1)
  • (16)
  • (1)
Molecular Weight (g/mol) 
  • (3)
  • (11)
  • (6)
  • (2)
  • (2)
  • (8)
  • (2)
  • (5)
  • (2)
  • (3)
  • (3)
  • (7)
  • (4)
  • (1)
  • (2)
  • (4)
  • (6)
  • (3)
  • (5)
  • (8)
  • (1)
  • (1)
  • (4)
  • (2)
  • (1)
  • (2)
  • (1)
  • (1)
  • (2)
  • (1)
  • (3)
  • (1)
  • (1)
  • (1)
  • (2)
  • (2)
  • (2)
  • (1)
  • (1)
  • (1)
  • (2)
  • (2)
  • (4)
  • (2)
  • (1)
  • (2)
  • (1)
  • (1)
  • (2)
  • (1)
  • (2)
  • (2)
  • (1)
  • (1)
  • (2)
  • (1)
Percent Purity 
  • (1)
  • (1)
  • (2)
  • (2)
  • (1)
  • (12)
  • (25)
  • (2)
  • (5)
  • (2)
  • (12)
  • (10)
  • (3)
  • (11)
  • (4)
  • (1)
  • (1)
  • (5)
  • (1)
  • (1)
  • (2)
  • (15)
  • (14)
  • (9)
Physical Form 
  • (85)
  • (1)
  • (5)
  • (3)
  • (4)
  • (2)
  • (4)
  • (5)
Boiling Point 
  • (2)
  • (2)
  • (1)
  • (2)
  • (1)
  • (3)
  • (1)
  • (5)
  • (1)
  • (3)
  • (3)
  • (1)

Filtered Search Results

Products from some of our suppliers do not display in filtered search results. Please clear all filters to see these products.

Narrow Results

Narrow Results

No results found within this category. Try removing some selected filters and try again.

category

brands

  • (5)
  • (85)
  • (60)

Quantity

  • (16)
  • (1)
  • (3)
  • (3)
  • (15)
  • (2)
  • (1)
  • (1)
  • (2)
  • (56)
  • (2)
  • (3)
  • (27)
  • (1)
  • (16)
  • (1)

Molecular Weight (g/mol)

  • (3)
  • (11)
  • (6)
  • (2)
  • (2)
  • (8)
  • (2)
  • (5)
  • (2)
  • (3)
  • (3)
  • (7)
  • (4)
  • (1)
  • (2)
  • (4)
  • (6)
  • (3)
  • (5)
  • (8)
  • (1)
  • (1)
  • (4)
  • (2)
  • (1)
  • (2)
  • (1)
  • (1)
  • (2)
  • (1)
  • (3)
  • (1)
  • (1)
  • (1)
  • (2)
  • (2)
  • (2)
  • (1)
  • (1)
  • (1)
  • (2)
  • (2)
  • (4)
  • (2)
  • (1)
  • (2)
  • (1)
  • (1)
  • (2)
  • (1)
  • (2)
  • (2)
  • (1)
  • (1)
  • (2)
  • (1)

Percent Purity

  • (1)
  • (1)
  • (2)
  • (2)
  • (1)
  • (12)
  • (25)
  • (2)
  • (5)
  • (2)
  • (12)
  • (10)
  • (3)
  • (11)
  • (4)
  • (1)
  • (1)
  • (5)
  • (1)
  • (1)
  • (2)
  • (15)
  • (14)
  • (9)

Physical Form

  • (85)
  • (1)
  • (5)
  • (3)
  • (4)
  • (2)
  • (4)
  • (5)

Boiling Point

  • (2)
  • (2)
  • (1)
  • (2)
  • (1)
  • (3)
  • (1)
  • (5)
  • (1)
  • (3)
  • (3)
  • (1)

Grade

  • (5)
1 – 15 of 89 results
1

3'-Nitroacetanilide, 98+%

CAS: 122-28-1 Molecular Formula: C8H8N2O3 Molecular Weight (g/mol): 180.163 MDL Number: MFCD00017015 InChI Key: KFTYNYHJHKCRKU-UHFFFAOYSA-N Synonym: n-3-nitrophenyl acetamide,3'-nitroacetanilide,m-nitroacetanilide,3-nitroacetanilide,acetamide, n-3-nitrophenyl,n-acetyl-m-nitroaniline,3-nitro-n-acetylaniline,acetanilide, 3'-nitro,unii-qgh8s22nbp,qgh8s22nbp PubChem CID: 31206 IUPAC Name: N-(3-nitrophenyl)acetamide SMILES: CC(=O)NC1=CC(=CC=C1)[N+](=O)[O-]

PubChem CID 31206
CAS 122-28-1
Molecular Weight (g/mol) 180.163
MDL Number MFCD00017015
SMILES CC(=O)NC1=CC(=CC=C1)[N+](=O)[O-]
Synonym n-3-nitrophenyl acetamide,3'-nitroacetanilide,m-nitroacetanilide,3-nitroacetanilide,acetamide, n-3-nitrophenyl,n-acetyl-m-nitroaniline,3-nitro-n-acetylaniline,acetanilide, 3'-nitro,unii-qgh8s22nbp,qgh8s22nbp
IUPAC Name N-(3-nitrophenyl)acetamide
InChI Key KFTYNYHJHKCRKU-UHFFFAOYSA-N
Molecular Formula C8H8N2O3
2

4-Acetamidobenzeneboronic acid, 96%

CAS: 101251-09-6 Molecular Formula: C8H10BNO3 Molecular Weight (g/mol): 178.98 MDL Number: MFCD02179451 InChI Key: VYEWTHXZHHATTA-UHFFFAOYSA-N Synonym: 4-acetylaminophenylboronic acid,4-acetamidophenyl boronic acid,p-acetamidophenylboronic acid,4-acetamidobenzeneboronic acid,4-acetamidophenyl-boronic acid,4-acetaminophenyl boronic acid,4-acetylaminophenyl boronic acid,4-acetylamino phenylboronic acid,boronic acid, 4-acetylamino phenyl PubChem CID: 2734657 IUPAC Name: (4-acetamidophenyl)boronic acid SMILES: CC(=O)NC1=CC=C(C=C1)B(O)O

PubChem CID 2734657
CAS 101251-09-6
Molecular Weight (g/mol) 178.98
MDL Number MFCD02179451
SMILES CC(=O)NC1=CC=C(C=C1)B(O)O
Synonym 4-acetylaminophenylboronic acid,4-acetamidophenyl boronic acid,p-acetamidophenylboronic acid,4-acetamidobenzeneboronic acid,4-acetamidophenyl-boronic acid,4-acetaminophenyl boronic acid,4-acetylaminophenyl boronic acid,4-acetylamino phenylboronic acid,boronic acid, 4-acetylamino phenyl
IUPAC Name (4-acetamidophenyl)boronic acid
InChI Key VYEWTHXZHHATTA-UHFFFAOYSA-N
Molecular Formula C8H10BNO3
3

3-Acetamidobenzeneboronic acid, 98%

CAS: 78887-39-5 Molecular Formula: C8H10BNO3 Molecular Weight (g/mol): 178.982 MDL Number: MFCD00236013 InChI Key: IBTSWKLSEOGJGJ-UHFFFAOYSA-N Synonym: 3-acetylaminophenylboronic acid,3-acetamidophenyl boronic acid,3-acetamidobenzeneboronic acid,3-acetylaminophenyl boronic acid,m-acetamidophenylboronic acid,boronic acid, 3-acetylamino phenyl,n-3-dihydroxyboranyl phenyl acetamide,3-acetylamino phenylboronic acid PubChem CID: 157274 IUPAC Name: (3-acetamidophenyl)boronic acid SMILES: B(C1=CC(=CC=C1)NC(=O)C)(O)O

PubChem CID 157274
CAS 78887-39-5
Molecular Weight (g/mol) 178.982
MDL Number MFCD00236013
SMILES B(C1=CC(=CC=C1)NC(=O)C)(O)O
Synonym 3-acetylaminophenylboronic acid,3-acetamidophenyl boronic acid,3-acetamidobenzeneboronic acid,3-acetylaminophenyl boronic acid,m-acetamidophenylboronic acid,boronic acid, 3-acetylamino phenyl,n-3-dihydroxyboranyl phenyl acetamide,3-acetylamino phenylboronic acid
IUPAC Name (3-acetamidophenyl)boronic acid
InChI Key IBTSWKLSEOGJGJ-UHFFFAOYSA-N
Molecular Formula C8H10BNO3
4

Naphthol AS, 99%

CAS: 92-77-3 Molecular Formula: C17H13NO2 Molecular Weight (g/mol): 263.28 MDL Number: MFCD00004096 InChI Key: JFGQHAHJWJBOPD-UHFFFAOYSA-N Synonym: naphthol as,3-hydroxy-2-naphthanilide,naphthol as supra,cibanaphthol rf,naphtanilide rc,azonaphtol a,dragonthol a,naftoelan a,naphtazol a,naphtholate as PubChem CID: 66719 IUPAC Name: 3-hydroxy-N-phenylnaphthalene-2-carboxamide SMILES: C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2O

PubChem CID 66719
CAS 92-77-3
Molecular Weight (g/mol) 263.28
MDL Number MFCD00004096
SMILES C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2O
Synonym naphthol as,3-hydroxy-2-naphthanilide,naphthol as supra,cibanaphthol rf,naphtanilide rc,azonaphtol a,dragonthol a,naftoelan a,naphtazol a,naphtholate as
IUPAC Name 3-hydroxy-N-phenylnaphthalene-2-carboxamide
InChI Key JFGQHAHJWJBOPD-UHFFFAOYSA-N
Molecular Formula C17H13NO2
5

4-Acetophenetidide, 97%

CAS: 62-44-2 Molecular Formula: C10H13NO2 Molecular Weight (g/mol): 179.22 MDL Number: MFCD00009094 InChI Key: CPJSUEIXXCENMM-UHFFFAOYSA-N Synonym: phenacetin,acetophenetidin,n-4-ethoxyphenyl acetamide,acetphenetidin,acetophenetidine,acetophenetin,phenacetine,p-acetophenetidide,contradouleur,achrocidin PubChem CID: 4754 ChEBI: CHEBI:8050 IUPAC Name: N-(4-ethoxyphenyl)acetamide SMILES: CCOC1=CC=C(C=C1)NC(=O)C

PubChem CID 4754
CAS 62-44-2
Molecular Weight (g/mol) 179.22
ChEBI CHEBI:8050
MDL Number MFCD00009094
SMILES CCOC1=CC=C(C=C1)NC(=O)C
Synonym phenacetin,acetophenetidin,n-4-ethoxyphenyl acetamide,acetphenetidin,acetophenetidine,acetophenetin,phenacetine,p-acetophenetidide,contradouleur,achrocidin
IUPAC Name N-(4-ethoxyphenyl)acetamide
InChI Key CPJSUEIXXCENMM-UHFFFAOYSA-N
Molecular Formula C10H13NO2
6

4-Acetamidobenzaldehyde, 98%

CAS: 122-85-0 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.176 MDL Number: MFCD00003380 InChI Key: SKLUWKYNZNXSLX-UHFFFAOYSA-N Synonym: 4-acetamidobenzaldehyde,n-4-formylphenyl acetamide,4-acetylaminobenzaldehyde,p-formylacetanilide,acetamide, n-4-formylphenyl,micotiazone,4-formylacetanilide,4'-formylacetanilide,p-acetamidobenzaldehyde,p-acetaminobenzaldehyde PubChem CID: 73942 IUPAC Name: N-(4-formylphenyl)acetamide SMILES: CC(=O)NC1=CC=C(C=C1)C=O

PubChem CID 73942
CAS 122-85-0
Molecular Weight (g/mol) 163.176
MDL Number MFCD00003380
SMILES CC(=O)NC1=CC=C(C=C1)C=O
Synonym 4-acetamidobenzaldehyde,n-4-formylphenyl acetamide,4-acetylaminobenzaldehyde,p-formylacetanilide,acetamide, n-4-formylphenyl,micotiazone,4-formylacetanilide,4'-formylacetanilide,p-acetamidobenzaldehyde,p-acetaminobenzaldehyde
IUPAC Name N-(4-formylphenyl)acetamide
InChI Key SKLUWKYNZNXSLX-UHFFFAOYSA-N
Molecular Formula C9H9NO2
7

2-Acetamidophenol, 97%

CAS: 614-80-2 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00002181 InChI Key: ADVGKWPZRIDURE-UHFFFAOYSA-N Synonym: 2-acetamidophenol,n-2-hydroxyphenyl acetamide,2'-hydroxyacetanilide,o-hydroxyacetanilide,2-acetaminophenol,2-hydroxyacetanilide,o-acetamidophenol,o-acetylamino phenol,2-acetylamino phenol,o-acetaminophenol PubChem CID: 11972 IUPAC Name: N-(2-hydroxyphenyl)acetamide SMILES: CC(=O)NC1=CC=CC=C1O

PubChem CID 11972
CAS 614-80-2
Molecular Weight (g/mol) 151.165
MDL Number MFCD00002181
SMILES CC(=O)NC1=CC=CC=C1O
Synonym 2-acetamidophenol,n-2-hydroxyphenyl acetamide,2'-hydroxyacetanilide,o-hydroxyacetanilide,2-acetaminophenol,2-hydroxyacetanilide,o-acetamidophenol,o-acetylamino phenol,2-acetylamino phenol,o-acetaminophenol
IUPAC Name N-(2-hydroxyphenyl)acetamide
InChI Key ADVGKWPZRIDURE-UHFFFAOYSA-N
Molecular Formula C8H9NO2
8

4'-Nitroacetanilide, 98%

CAS: 104-04-1 Molecular Formula: C8H8N2O3 Molecular Weight (g/mol): 180.163 MDL Number: MFCD00007303 InChI Key: NQRLPDFELNCFHW-UHFFFAOYSA-N Synonym: 4'-nitroacetanilide,n-4-nitrophenyl acetamide,4-nitroacetanilide,p-nitroacetanilide,acetamide, n-4-nitrophenyl,n-acetyl-4-nitroaniline,p-acetamidonitrobenzene,acetanilide, p-nitro,p-nitrophenylacetanilide,n-acetyl-p-nitroaniline PubChem CID: 7691 IUPAC Name: N-(4-nitrophenyl)acetamide SMILES: CC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]

PubChem CID 7691
CAS 104-04-1
Molecular Weight (g/mol) 180.163
MDL Number MFCD00007303
SMILES CC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]
Synonym 4'-nitroacetanilide,n-4-nitrophenyl acetamide,4-nitroacetanilide,p-nitroacetanilide,acetamide, n-4-nitrophenyl,n-acetyl-4-nitroaniline,p-acetamidonitrobenzene,acetanilide, p-nitro,p-nitrophenylacetanilide,n-acetyl-p-nitroaniline
IUPAC Name N-(4-nitrophenyl)acetamide
InChI Key NQRLPDFELNCFHW-UHFFFAOYSA-N
Molecular Formula C8H8N2O3
9

4'-Cyanoacetanilide, 98%

CAS: 35704-19-9 Molecular Formula: C9H8N2O Molecular Weight (g/mol): 160.18 MDL Number: MFCD00001814 InChI Key: UFKRTEWFEYWIHD-UHFFFAOYSA-N Synonym: n-4-cyanophenyl acetamide,4-cyanoacetanilide,4-acetamidobenzonitrile,acetamide, n-4-cyanophenyl,4'-cyanoacetanilide,p-acetamidobenzonitirle,acetanilide, 4'-cyano,p-acetylamino-benzonitrile,p-cyanoacetanilide,p-acetaminobenzonitrile PubChem CID: 37256 IUPAC Name: N-(4-cyanophenyl)acetamide SMILES: CC(=O)NC1=CC=C(C=C1)C#N

PubChem CID 37256
CAS 35704-19-9
Molecular Weight (g/mol) 160.18
MDL Number MFCD00001814
SMILES CC(=O)NC1=CC=C(C=C1)C#N
Synonym n-4-cyanophenyl acetamide,4-cyanoacetanilide,4-acetamidobenzonitrile,acetamide, n-4-cyanophenyl,4'-cyanoacetanilide,p-acetamidobenzonitirle,acetanilide, 4'-cyano,p-acetylamino-benzonitrile,p-cyanoacetanilide,p-acetaminobenzonitrile
IUPAC Name N-(4-cyanophenyl)acetamide
InChI Key UFKRTEWFEYWIHD-UHFFFAOYSA-N
Molecular Formula C9H8N2O
10

3-Acetamidophenol, 98%

CAS: 621-42-1 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00002263 InChI Key: QLNWXBAGRTUKKI-UHFFFAOYSA-N Synonym: 3-acetamidophenol,n-3-hydroxyphenyl acetamide,metacetamol,3'-hydroxyacetanilide,m-acetamidophenol,3-hydroxyacetanilide,n-acetyl-m-aminophenol,m-hydroxyacetanilide,3-acetylamino phenol,metalid PubChem CID: 12124 ChEBI: CHEBI:76987 IUPAC Name: N-(3-hydroxyphenyl)acetamide SMILES: CC(=O)NC1=CC(=CC=C1)O

PubChem CID 12124
CAS 621-42-1
Molecular Weight (g/mol) 151.165
ChEBI CHEBI:76987
MDL Number MFCD00002263
SMILES CC(=O)NC1=CC(=CC=C1)O
Synonym 3-acetamidophenol,n-3-hydroxyphenyl acetamide,metacetamol,3'-hydroxyacetanilide,m-acetamidophenol,3-hydroxyacetanilide,n-acetyl-m-aminophenol,m-hydroxyacetanilide,3-acetylamino phenol,metalid
IUPAC Name N-(3-hydroxyphenyl)acetamide
InChI Key QLNWXBAGRTUKKI-UHFFFAOYSA-N
Molecular Formula C8H9NO2
11

2'-Methylacetanilide, 98+%

CAS: 120-66-1 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.193 MDL Number: MFCD00014961 InChI Key: BPEXTIMJLDWDTL-UHFFFAOYSA-N Synonym: o-acetotoluidide,2'-methylacetanilide,n-o-tolyl acetamide,n-2-methylphenyl acetamide,acetyl-o-toluidine,n-acetyl-o-toluidine,o-acetotoluide,acetamide, n-2-methylphenyl,o-methylacetanilide,n-o-tolylacetamide PubChem CID: 8443 IUPAC Name: N-(2-methylphenyl)acetamide SMILES: CC1=CC=CC=C1NC(=O)C

PubChem CID 8443
CAS 120-66-1
Molecular Weight (g/mol) 149.193
MDL Number MFCD00014961
SMILES CC1=CC=CC=C1NC(=O)C
Synonym o-acetotoluidide,2'-methylacetanilide,n-o-tolyl acetamide,n-2-methylphenyl acetamide,acetyl-o-toluidine,n-acetyl-o-toluidine,o-acetotoluide,acetamide, n-2-methylphenyl,o-methylacetanilide,n-o-tolylacetamide
IUPAC Name N-(2-methylphenyl)acetamide
InChI Key BPEXTIMJLDWDTL-UHFFFAOYSA-N
Molecular Formula C9H11NO
12

4'-(Trifluoromethyl)acetanilide, 98+%

CAS: 349-97-3 Molecular Formula: C9H8F3NO Molecular Weight (g/mol): 203.164 MDL Number: MFCD00013562 InChI Key: DFDHFECLWHHELH-UHFFFAOYSA-N Synonym: 4-trifluoromethyl acetanilide,n-4-trifluoromethyl phenyl acetamide,4'-trifluoromethyl acetanilide,4-trifluoromethylacetanilide,p-acetaminobenzotrifluoride,p-acetamidobenzotrifluoride,p-trifluoromethylacetanilide,p-acetylaminobenzotrifluoride,p-trifluoromethyl acetanilide PubChem CID: 67685 IUPAC Name: N-[4-(trifluoromethyl)phenyl]acetamide SMILES: CC(=O)NC1=CC=C(C=C1)C(F)(F)F

PubChem CID 67685
CAS 349-97-3
Molecular Weight (g/mol) 203.164
MDL Number MFCD00013562
SMILES CC(=O)NC1=CC=C(C=C1)C(F)(F)F
Synonym 4-trifluoromethyl acetanilide,n-4-trifluoromethyl phenyl acetamide,4'-trifluoromethyl acetanilide,4-trifluoromethylacetanilide,p-acetaminobenzotrifluoride,p-acetamidobenzotrifluoride,p-trifluoromethylacetanilide,p-acetylaminobenzotrifluoride,p-trifluoromethyl acetanilide
IUPAC Name N-[4-(trifluoromethyl)phenyl]acetamide
InChI Key DFDHFECLWHHELH-UHFFFAOYSA-N
Molecular Formula C9H8F3NO
13

2'-Nitroacetanilide, 98+%

CAS: 552-32-9 Molecular Formula: C8H8N2O3 Molecular Weight (g/mol): 180.16 MDL Number: MFCD00016991 InChI Key: BUNFNRVLMKHKIT-UHFFFAOYSA-N Synonym: n-2-nitrophenyl acetamide,2'-nitroacetanilide,o-nitroacetanilide,2-nitroacetanilide,acetamide, n-2-nitrophenyl,acetanilide, 2'-nitro,unii-q4kjc83992,o-nitroacetoanilide,zlchem 447,pubchem3357 PubChem CID: 11090 IUPAC Name: N-(2-nitrophenyl)acetamide SMILES: CC(=O)NC1=CC=CC=C1[N+]([O-])=O

PubChem CID 11090
CAS 552-32-9
Molecular Weight (g/mol) 180.16
MDL Number MFCD00016991
SMILES CC(=O)NC1=CC=CC=C1[N+]([O-])=O
Synonym n-2-nitrophenyl acetamide,2'-nitroacetanilide,o-nitroacetanilide,2-nitroacetanilide,acetamide, n-2-nitrophenyl,acetanilide, 2'-nitro,unii-q4kjc83992,o-nitroacetoanilide,zlchem 447,pubchem3357
IUPAC Name N-(2-nitrophenyl)acetamide
InChI Key BUNFNRVLMKHKIT-UHFFFAOYSA-N
Molecular Formula C8H8N2O3
14

N-(2-Hydroxy-4-methylphenyl)acetamide, 97%, Thermo Scientific Chemicals

CAS: 13429-10-2 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.192 MDL Number: MFCD00012061 InChI Key: HTVPAACTHAQQAS-UHFFFAOYSA-N Synonym: n-2-hydroxy-4-methylphenyl acetamide,acetamide, n-2-hydroxy-4-methylphenyl,acetamide,n-2-hydroxy-4-methylphenyl,6-acetamino-m-kresol,2'-hydroxy-p-acetotoluidide,2'-hydroxy-4'-methylacetoanilide,2-acetamido-5-methylphenol,n-2-hydroxy-4-methyl-phenyl-acetamide PubChem CID: 83437 IUPAC Name: N-(2-hydroxy-4-methylphenyl)acetamide SMILES: CC1=CC(=C(C=C1)NC(=O)C)O

PubChem CID 83437
CAS 13429-10-2
Molecular Weight (g/mol) 165.192
MDL Number MFCD00012061
SMILES CC1=CC(=C(C=C1)NC(=O)C)O
Synonym n-2-hydroxy-4-methylphenyl acetamide,acetamide, n-2-hydroxy-4-methylphenyl,acetamide,n-2-hydroxy-4-methylphenyl,6-acetamino-m-kresol,2'-hydroxy-p-acetotoluidide,2'-hydroxy-4'-methylacetoanilide,2-acetamido-5-methylphenol,n-2-hydroxy-4-methyl-phenyl-acetamide
IUPAC Name N-(2-hydroxy-4-methylphenyl)acetamide
InChI Key HTVPAACTHAQQAS-UHFFFAOYSA-N
Molecular Formula C9H11NO2
15

m-Tolyl acetate, 97%

CAS: 111072-31-2 Molecular Formula: C22H16N7NaO13S2 Molecular Weight (g/mol): 673.52 MDL Number: MFCD00083517 InChI Key: JACYMBNQPPWQML-UHFFFAOYSA-M Synonym: xtt PubChem CID: 131668615 IUPAC Name: sodium;2-(2-methoxy-4-nitro-5-sulfonatophenyl)-3-(2-methoxy-4-nitro-5-sulfophenyl)-N-phenyltetrazol-3-ium-5-carboximidate SMILES: [Na+].COC1=C(C=C(C(=C1)[N+]([O-])=O)S([O-])(=O)=O)N1N=C(N=[N+]1C1=C(OC)C=C(C(=C1)S([O-])(=O)=O)[N+]([O-])=O)C(=O)NC1=CC=CC=C1

PubChem CID 131668615
CAS 111072-31-2
Molecular Weight (g/mol) 673.52
MDL Number MFCD00083517
SMILES [Na+].COC1=C(C=C(C(=C1)[N+]([O-])=O)S([O-])(=O)=O)N1N=C(N=[N+]1C1=C(OC)C=C(C(=C1)S([O-])(=O)=O)[N+]([O-])=O)C(=O)NC1=CC=CC=C1
Synonym xtt
IUPAC Name sodium;2-(2-methoxy-4-nitro-5-sulfonatophenyl)-3-(2-methoxy-4-nitro-5-sulfophenyl)-N-phenyltetrazol-3-ium-5-carboximidate
InChI Key JACYMBNQPPWQML-UHFFFAOYSA-M
Molecular Formula C22H16N7NaO13S2