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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.
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1 – 15 de 89 résultats
1

4'-Ethoxyacetanilide, 97%, Thermo Scientific Chemicals

CAS: 62-44-2 Formule moléculaire: C10H13NO2 Poids moléculaire (g/mol): 179.219 Numéro MDL: MFCD00009094 Clé InChI: CPJSUEIXXCENMM-UHFFFAOYSA-N Synonyme: phenacetin,acetophenetidin,n-4-ethoxyphenyl acetamide,acetphenetidin,acetophenetidine,acetophenetin,phenacetine,p-acetophenetidide,contradouleur,achrocidin CID PubChem: 4754 ChEBI: CHEBI:8050 Nom IUPAC: N-(4-ethoxyphenyl)acetamide SMILES: CCOC1=CC=C(C=C1)NC(=O)C

Poids moléculaire (g/mol) 179.219
Synonyme phenacetin,acetophenetidin,n-4-ethoxyphenyl acetamide,acetphenetidin,acetophenetidine,acetophenetin,phenacetine,p-acetophenetidide,contradouleur,achrocidin
Numéro MDL MFCD00009094
CAS 62-44-2
CID PubChem 4754
ChEBI CHEBI:8050
Nom IUPAC N-(4-ethoxyphenyl)acetamide
Clé InChI CPJSUEIXXCENMM-UHFFFAOYSA-N
SMILES CCOC1=CC=C(C=C1)NC(=O)C
Formule moléculaire C10H13NO2
2

3-Acetamidophenol, 98%

CAS: 621-42-1 Formule moléculaire: C8H9NO2 Poids moléculaire (g/mol): 151.165 Numéro MDL: MFCD00002263 Clé InChI: QLNWXBAGRTUKKI-UHFFFAOYSA-N Synonyme: 3-acetamidophenol,n-3-hydroxyphenyl acetamide,metacetamol,3'-hydroxyacetanilide,m-acetamidophenol,3-hydroxyacetanilide,n-acetyl-m-aminophenol,m-hydroxyacetanilide,3-acetylamino phenol,metalid CID PubChem: 12124 ChEBI: CHEBI:76987 Nom IUPAC: N-(3-hydroxyphenyl)acetamide SMILES: CC(=O)NC1=CC(=CC=C1)O

Poids moléculaire (g/mol) 151.165
Synonyme 3-acetamidophenol,n-3-hydroxyphenyl acetamide,metacetamol,3'-hydroxyacetanilide,m-acetamidophenol,3-hydroxyacetanilide,n-acetyl-m-aminophenol,m-hydroxyacetanilide,3-acetylamino phenol,metalid
Numéro MDL MFCD00002263
CAS 621-42-1
CID PubChem 12124
ChEBI CHEBI:76987
Nom IUPAC N-(3-hydroxyphenyl)acetamide
Clé InChI QLNWXBAGRTUKKI-UHFFFAOYSA-N
SMILES CC(=O)NC1=CC(=CC=C1)O
Formule moléculaire C8H9NO2
3

4'-(Trifluoromethyl)acetanilide, 98+%

CAS: 349-97-3 Formule moléculaire: C9H8F3NO Poids moléculaire (g/mol): 203.164 Numéro MDL: MFCD00013562 Clé InChI: DFDHFECLWHHELH-UHFFFAOYSA-N Synonyme: 4-trifluoromethyl acetanilide,n-4-trifluoromethyl phenyl acetamide,4'-trifluoromethyl acetanilide,4-trifluoromethylacetanilide,p-acetaminobenzotrifluoride,p-acetamidobenzotrifluoride,p-trifluoromethylacetanilide,p-acetylaminobenzotrifluoride,p-trifluoromethyl acetanilide CID PubChem: 67685 Nom IUPAC: N-[4-(trifluoromethyl)phenyl]acetamide SMILES: CC(=O)NC1=CC=C(C=C1)C(F)(F)F

Poids moléculaire (g/mol) 203.164
Synonyme 4-trifluoromethyl acetanilide,n-4-trifluoromethyl phenyl acetamide,4'-trifluoromethyl acetanilide,4-trifluoromethylacetanilide,p-acetaminobenzotrifluoride,p-acetamidobenzotrifluoride,p-trifluoromethylacetanilide,p-acetylaminobenzotrifluoride,p-trifluoromethyl acetanilide
Numéro MDL MFCD00013562
CAS 349-97-3
CID PubChem 67685
Nom IUPAC N-[4-(trifluoromethyl)phenyl]acetamide
Clé InChI DFDHFECLWHHELH-UHFFFAOYSA-N
SMILES CC(=O)NC1=CC=C(C=C1)C(F)(F)F
Formule moléculaire C9H8F3NO
4

4'-Nitroacetanilide, 98%

CAS: 104-04-1 Formule moléculaire: C8H8N2O3 Poids moléculaire (g/mol): 180.163 Numéro MDL: MFCD00007303 Clé InChI: NQRLPDFELNCFHW-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 7691 Nom IUPAC: N-(4-nitrophenyl)acetamide SMILES: CC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]

Poids moléculaire (g/mol) 180.163
Synonyme 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
Numéro MDL MFCD00007303
CAS 104-04-1
CID PubChem 7691
Nom IUPAC N-(4-nitrophenyl)acetamide
Clé InChI NQRLPDFELNCFHW-UHFFFAOYSA-N
SMILES CC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]
Formule moléculaire C8H8N2O3
5

4'-Methylacetanilide, 98+%

CAS: 103-89-9 Formule moléculaire: C9H11NO Poids moléculaire (g/mol): 149.193 Numéro MDL: MFCD00008677 Clé InChI: YICAMJWHIUMFDI-UHFFFAOYSA-N Synonyme: 4'-methylacetanilide,p-acetotoluidide,n-4-methylphenyl acetamide,4-methylacetanilide,n-acetyl-p-toluidine,p-acetotoluide,acetyl-p-toluidine,p-acetotoluidine,acetamide, n-4-methylphenyl,4-acetotoluide CID PubChem: 7684 Nom IUPAC: N-(4-methylphenyl)acetamide SMILES: CC1=CC=C(C=C1)NC(=O)C

Poids moléculaire (g/mol) 149.193
Synonyme 4'-methylacetanilide,p-acetotoluidide,n-4-methylphenyl acetamide,4-methylacetanilide,n-acetyl-p-toluidine,p-acetotoluide,acetyl-p-toluidine,p-acetotoluidine,acetamide, n-4-methylphenyl,4-acetotoluide
Numéro MDL MFCD00008677
CAS 103-89-9
CID PubChem 7684
Nom IUPAC N-(4-methylphenyl)acetamide
Clé InChI YICAMJWHIUMFDI-UHFFFAOYSA-N
SMILES CC1=CC=C(C=C1)NC(=O)C
Formule moléculaire C9H11NO
6

2'-Nitroacetanilide, 98+%

CAS: 552-32-9 Formule moléculaire: C8H8N2O3 Poids moléculaire (g/mol): 180.16 Numéro MDL: MFCD00016991 Clé InChI: BUNFNRVLMKHKIT-UHFFFAOYSA-N Synonyme: n-2-nitrophenyl acetamide,2'-nitroacetanilide,o-nitroacetanilide,2-nitroacetanilide,acetamide, n-2-nitrophenyl,acetanilide, 2'-nitro,unii-q4kjc83992,o-nitroacetoanilide,zlchem 447,pubchem3357 CID PubChem: 11090 Nom IUPAC: N-(2-nitrophenyl)acetamide SMILES: CC(=O)NC1=CC=CC=C1[N+]([O-])=O

Poids moléculaire (g/mol) 180.16
Synonyme n-2-nitrophenyl acetamide,2'-nitroacetanilide,o-nitroacetanilide,2-nitroacetanilide,acetamide, n-2-nitrophenyl,acetanilide, 2'-nitro,unii-q4kjc83992,o-nitroacetoanilide,zlchem 447,pubchem3357
Numéro MDL MFCD00016991
CAS 552-32-9
CID PubChem 11090
Nom IUPAC N-(2-nitrophenyl)acetamide
Clé InChI BUNFNRVLMKHKIT-UHFFFAOYSA-N
SMILES CC(=O)NC1=CC=CC=C1[N+]([O-])=O
Formule moléculaire C8H8N2O3
7

4'-Cyanoacetanilide, 98%

CAS: 35704-19-9 Formule moléculaire: C9H8N2O Poids moléculaire (g/mol): 160.18 Numéro MDL: MFCD00001814 Clé InChI: UFKRTEWFEYWIHD-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 37256 Nom IUPAC: N-(4-cyanophenyl)acetamide SMILES: CC(=O)NC1=CC=C(C=C1)C#N

Poids moléculaire (g/mol) 160.18
Synonyme 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
Numéro MDL MFCD00001814
CAS 35704-19-9
CID PubChem 37256
Nom IUPAC N-(4-cyanophenyl)acetamide
Clé InChI UFKRTEWFEYWIHD-UHFFFAOYSA-N
SMILES CC(=O)NC1=CC=C(C=C1)C#N
Formule moléculaire C9H8N2O
8

N,N'-p-Phenylenebisacetamide, 98%

CAS: 140-50-1 Formule moléculaire: C10H12N2O2 Poids moléculaire (g/mol): 192.218 Numéro MDL: MFCD00026142 Clé InChI: KVEDKKLZCJBVNP-UHFFFAOYSA-N Synonyme: 1,4-diacetamidobenzene,n,n'-diacetyl-1,4-phenylenediamine,n,n'-p-phenylenebisacetamide,p-phenylenediacetamide,n,n'-diacetyl-p-phenylenediamine,4'-acetamidoacetanilide,1,4-bisacetamidobenzene,acetamide, n,n'-1,4-phenylenebis,n-4-acetamidophenyl acetamide,n,n'-p-phenylene di acetamide CID PubChem: 67324 Nom IUPAC: N-(4-acetamidophenyl)acetamide SMILES: CC(=O)NC1=CC=C(C=C1)NC(=O)C

Poids moléculaire (g/mol) 192.218
Synonyme 1,4-diacetamidobenzene,n,n'-diacetyl-1,4-phenylenediamine,n,n'-p-phenylenebisacetamide,p-phenylenediacetamide,n,n'-diacetyl-p-phenylenediamine,4'-acetamidoacetanilide,1,4-bisacetamidobenzene,acetamide, n,n'-1,4-phenylenebis,n-4-acetamidophenyl acetamide,n,n'-p-phenylene di acetamide
Numéro MDL MFCD00026142
CAS 140-50-1
CID PubChem 67324
Nom IUPAC N-(4-acetamidophenyl)acetamide
Clé InChI KVEDKKLZCJBVNP-UHFFFAOYSA-N
SMILES CC(=O)NC1=CC=C(C=C1)NC(=O)C
Formule moléculaire C10H12N2O2
9

4-Acetamidobenzyl alcohol, 97%

CAS: 16375-88-5 Formule moléculaire: C9H11NO2 Poids moléculaire (g/mol): 165.19 Numéro MDL: MFCD00016868 Clé InChI: XEYORFKUJZEQCH-UHFFFAOYSA-N Synonyme: 4-acetamidobenzyl alcohol,n-4-hydroxymethyl phenyl acetamide,4-acetaminobenzyl alcohol,4-acetamidobenzylalcohol,n-4-hydroxymethyl-phenyl-acetamide,p-acetaminobenzyl alcohol,acetamide, n-4-hydroxymethyl phenyl,4-acetylamino benzyl alcohol CID PubChem: 152141 Nom IUPAC: N-[4-(hydroxymethyl)phenyl]acetamide SMILES: CC(=O)NC1=CC=C(CO)C=C1

Poids moléculaire (g/mol) 165.19
Synonyme 4-acetamidobenzyl alcohol,n-4-hydroxymethyl phenyl acetamide,4-acetaminobenzyl alcohol,4-acetamidobenzylalcohol,n-4-hydroxymethyl-phenyl-acetamide,p-acetaminobenzyl alcohol,acetamide, n-4-hydroxymethyl phenyl,4-acetylamino benzyl alcohol
Numéro MDL MFCD00016868
CAS 16375-88-5
CID PubChem 152141
Nom IUPAC N-[4-(hydroxymethyl)phenyl]acetamide
Clé InChI XEYORFKUJZEQCH-UHFFFAOYSA-N
SMILES CC(=O)NC1=CC=C(CO)C=C1
Formule moléculaire C9H11NO2
10

4-Acetamidobenzeneboronic acid, 96%

CAS: 101251-09-6 Formule moléculaire: C8H10BNO3 Poids moléculaire (g/mol): 178.98 Numéro MDL: MFCD02179451 Clé InChI: VYEWTHXZHHATTA-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 2734657 Nom IUPAC: (4-acetamidophenyl)boronic acid SMILES: CC(=O)NC1=CC=C(C=C1)B(O)O

Poids moléculaire (g/mol) 178.98
Synonyme 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
Numéro MDL MFCD02179451
CAS 101251-09-6
CID PubChem 2734657
Nom IUPAC (4-acetamidophenyl)boronic acid
Clé InChI VYEWTHXZHHATTA-UHFFFAOYSA-N
SMILES CC(=O)NC1=CC=C(C=C1)B(O)O
Formule moléculaire C8H10BNO3
11

AM 580

CAS: 102121-60-8 Formule moléculaire: C22H25NO3 Poids moléculaire (g/mol): 351.45 Numéro MDL: MFCD00673916 Clé InChI: SZWKGOZKRMMLAJ-UHFFFAOYSA-N Synonyme: unii-vz5s5g9zfz,4-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl carbonyl amino benzoic acid,vz5s5g9zfz,chembl69367,4-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carboxamido benzoic acid,benzoic acid,4-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl carbonyl amino,4-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl carbonyl aminobenzoic acid,4-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl carboxamido benzoic acid,4-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl carbonyl amino benzoic acid,benzoic acid, 4-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl carbonyl amino CID PubChem: 2126 ChEBI: CHEBI:64210 Nom IUPAC: 4-[(5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbonyl)amino]benzoic acid SMILES: CC1(C)CCC(C)(C)C2=CC(=CC=C12)C(=O)NC1=CC=C(C=C1)C(O)=O

Poids moléculaire (g/mol) 351.45
Synonyme unii-vz5s5g9zfz,4-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl carbonyl amino benzoic acid,vz5s5g9zfz,chembl69367,4-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carboxamido benzoic acid,benzoic acid,4-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl carbonyl amino,4-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl carbonyl aminobenzoic acid,4-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl carboxamido benzoic acid,4-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl carbonyl amino benzoic acid,benzoic acid, 4-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl carbonyl amino
Numéro MDL MFCD00673916
CAS 102121-60-8
CID PubChem 2126
ChEBI CHEBI:64210
Nom IUPAC 4-[(5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbonyl)amino]benzoic acid
Clé InChI SZWKGOZKRMMLAJ-UHFFFAOYSA-N
SMILES CC1(C)CCC(C)(C)C2=CC(=CC=C12)C(=O)NC1=CC=C(C=C1)C(O)=O
Formule moléculaire C22H25NO3
12

Linomide

CAS: 84088-42-6 Formule moléculaire: C18H16N2O3 Poids moléculaire (g/mol): 308.337 Numéro MDL: MFCD00866331 Clé InChI: SGOOQMRIPALTEL-UHFFFAOYSA-N Synonyme: linomide,roquinimex,roquinimexum latin,roquinimex usan:inn,ccris 7673,fcf 89,fcf-89,n-phenyl-n-methyl-1,2-dihydro-4-hydroxy-1-methyl-2-oxo-quinoline-3-carboxamide,1,2-dihydro-4-hydroxy-n,1-dimethyl-2-oxo-3-quinolinecarboxanilide,4-hydroxy-n,1-dimethyl-2-oxo-n-phenyl-1,2-dihydroquinoline-3-carboxamide CID PubChem: 54676478 Nom IUPAC: 4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide SMILES: CN1C2=CC=CC=C2C(=C(C1=O)C(=O)N(C)C3=CC=CC=C3)O

Poids moléculaire (g/mol) 308.337
Synonyme linomide,roquinimex,roquinimexum latin,roquinimex usan:inn,ccris 7673,fcf 89,fcf-89,n-phenyl-n-methyl-1,2-dihydro-4-hydroxy-1-methyl-2-oxo-quinoline-3-carboxamide,1,2-dihydro-4-hydroxy-n,1-dimethyl-2-oxo-3-quinolinecarboxanilide,4-hydroxy-n,1-dimethyl-2-oxo-n-phenyl-1,2-dihydroquinoline-3-carboxamide
Numéro MDL MFCD00866331
CAS 84088-42-6
CID PubChem 54676478
Nom IUPAC 4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide
Clé InChI SGOOQMRIPALTEL-UHFFFAOYSA-N
SMILES CN1C2=CC=CC=C2C(=C(C1=O)C(=O)N(C)C3=CC=CC=C3)O
Formule moléculaire C18H16N2O3
13

Leflunomide

CAS: 75706-12-6 Formule moléculaire: C12H9F3N2O2 Poids moléculaire (g/mol): 270.211 Numéro MDL: MFCD00867593 Clé InChI: VHOGYURTWQBHIL-UHFFFAOYSA-N Synonyme: leflunomide,arava,leflunomidum,lefunamide,leflunomida,leflunomidum inn-latin,5-methyl-n-4-trifluoromethyl phenyl-1,2-oxazole-4-carboxamide,leflunomida inn-spanish,su 101 pharmaceutical,arava tn CID PubChem: 3899 ChEBI: CHEBI:6402 Nom IUPAC: 5-methyl-N-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide SMILES: CC1=C(C=NO1)C(=O)NC2=CC=C(C=C2)C(F)(F)F

Poids moléculaire (g/mol) 270.211
Synonyme leflunomide,arava,leflunomidum,lefunamide,leflunomida,leflunomidum inn-latin,5-methyl-n-4-trifluoromethyl phenyl-1,2-oxazole-4-carboxamide,leflunomida inn-spanish,su 101 pharmaceutical,arava tn
Numéro MDL MFCD00867593
CAS 75706-12-6
CID PubChem 3899
ChEBI CHEBI:6402
Nom IUPAC 5-methyl-N-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide
Clé InChI VHOGYURTWQBHIL-UHFFFAOYSA-N
SMILES CC1=C(C=NO1)C(=O)NC2=CC=C(C=C2)C(F)(F)F
Formule moléculaire C12H9F3N2O2
14

N-Acetylsulfanilyl chloride, 99%

CAS: 121-60-8 Formule moléculaire: C8H8ClNO3S Poids moléculaire (g/mol): 233.67 Numéro MDL: MFCD00007442 Clé InChI: GRDXCFKBQWDAJH-UHFFFAOYSA-N Synonyme: n-acetylsulfanilyl chloride,4-acetamidobenzene-1-sulfonyl chloride,dagenan chloride,4-acetylamino benzenesulfonyl chloride,4-acetamidophenylsulfonyl chloride,benzenesulfonyl chloride, 4-acetylamino,acetylsulfanilyl chloride,p-acetamidobenzenesulfonyl chloride,n-acetylsulphanilyl chloride,p-acetaminobenzenesulfonyl chloride CID PubChem: 8481 Nom IUPAC: 4-acetamidobenzenesulfonyl chloride SMILES: CC(=O)NC1=CC=C(C=C1)S(Cl)(=O)=O

Poids moléculaire (g/mol) 233.67
Synonyme n-acetylsulfanilyl chloride,4-acetamidobenzene-1-sulfonyl chloride,dagenan chloride,4-acetylamino benzenesulfonyl chloride,4-acetamidophenylsulfonyl chloride,benzenesulfonyl chloride, 4-acetylamino,acetylsulfanilyl chloride,p-acetamidobenzenesulfonyl chloride,n-acetylsulphanilyl chloride,p-acetaminobenzenesulfonyl chloride
Numéro MDL MFCD00007442
CAS 121-60-8
CID PubChem 8481
Nom IUPAC 4-acetamidobenzenesulfonyl chloride
Clé InChI GRDXCFKBQWDAJH-UHFFFAOYSA-N
SMILES CC(=O)NC1=CC=C(C=C1)S(Cl)(=O)=O
Formule moléculaire C8H8ClNO3S
15

m-Tolyl acetate, 97%

CAS: 111072-31-2 Formule moléculaire: C22H16N7NaO13S2 Poids moléculaire (g/mol): 673.52 Numéro MDL: MFCD00083517 Clé InChI: JACYMBNQPPWQML-UHFFFAOYSA-M Synonyme: xtt CID PubChem: 131668615 Nom IUPAC: 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

Poids moléculaire (g/mol) 673.52
Synonyme xtt
Numéro MDL MFCD00083517
CAS 111072-31-2
CID PubChem 131668615
Nom IUPAC sodium;2-(2-methoxy-4-nitro-5-sulfonatophenyl)-3-(2-methoxy-4-nitro-5-sulfophenyl)-N-phenyltetrazol-3-ium-5-carboximidate
Clé InChI JACYMBNQPPWQML-UHFFFAOYSA-M
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
Formule moléculaire C22H16N7NaO13S2