Isoquinolines and derivatives

Aromatic heterocyclic organic compounds that consist of a benzene ring fused to a pyridine ring; they are structural isomers of quinoline. Includes compounds that are derived from isoquinolines.

1 – 15 of 28 results

Gliquidone, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™

This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.

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Naloxone hydrochloride, 98%

CAS: 357-08-4 Molecular Formula: C19H22ClNO4 Molecular Weight (g/mol): 363.838 MDL Number: MFCD00069322 InChI Key: RGPDIGOSVORSAK-STHHAXOLSA-N Synonym: naloxone hydrochloride,naloxone hcl,narcan,evzio,unii-f850569pqr,nalonee,17-allyl-4,5alpha-epoxy-3,14-dihydroxymorphinan-6-one hydrochloride,narcan tn,naloxonehydrochloride PubChem CID: 5464092 IUPAC Name: (4R,4aS,7aR,12bS)-4a,9-dihydroxy-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride SMILES: C=CCN1CCC23C4C(=O)CCC2(C1CC5=C3C(=C(C=C5)O)O4)O.Cl

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Specifications

PubChem CID	5464092
CAS	357-08-4
Molecular Weight (g/mol)	363.838
MDL Number	MFCD00069322
SMILES	C=CCN1CCC23C4C(=O)CCC2(C1CC5=C3C(=C(C=C5)O)O4)O.Cl
Synonym	naloxone hydrochloride,naloxone hcl,narcan,evzio,unii-f850569pqr,nalonee,17-allyl-4,5alpha-epoxy-3,14-dihydroxymorphinan-6-one hydrochloride,narcan tn,naloxonehydrochloride
IUPAC Name	(4R,4aS,7aR,12bS)-4a,9-dihydroxy-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride
InChI Key	RGPDIGOSVORSAK-STHHAXOLSA-N
Molecular Formula	C19H22ClNO4

Papaverine hydrochloride, 99%

CAS: 61-25-6 Molecular Formula: C₂₀H₂₁NO₄·ClH Molecular Weight (g/mol): 375.85 MDL Number: MFCD00012745 InChI Key: UOTMYNBWXDUBNX-UHFFFAOYSA-N Synonym: papaverine hydrochloride,cardiospan,cardoverina,dispamil,drapavel,forpavin,papalease,papaversan,pavatest,paverolan PubChem CID: 6084 IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline;hydrochloride SMILES: COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC.Cl

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Specifications

PubChem CID	6084
CAS	61-25-6
Molecular Weight (g/mol)	375.85
MDL Number	MFCD00012745
SMILES	COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC.Cl
Synonym	papaverine hydrochloride,cardiospan,cardoverina,dispamil,drapavel,forpavin,papalease,papaversan,pavatest,paverolan
IUPAC Name	1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline;hydrochloride
InChI Key	UOTMYNBWXDUBNX-UHFFFAOYSA-N
Molecular Formula	C₂₀H₂₁NO₄·ClH

1,8-Naphthalimide, 98%

CAS: 81-83-4 Molecular Formula: C12H7NO2 Molecular Weight (g/mol): 197.193 MDL Number: MFCD00006920 InChI Key: XJHABGPPCLHLLV-UHFFFAOYSA-N Synonym: 1,8-naphthalimide,naphthalimide,1h-benz de isoquinoline-1,3 2h-dione,1h-benzo de isoquinoline-1,3 2h-dione,1,8-naphthalenedicarboximide,benzo de isoquinoline-1,3-dione,unii-gi0tv19gbn,naphthalene-1,8-dicarboximide,gi0tv19gbn PubChem CID: 66491 IUPAC Name: benzo[de]isoquinoline-1,3-dione SMILES: C1=CC2=C3C(=C1)C(=O)NC(=O)C3=CC=C2

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Specifications

PubChem CID	66491
CAS	81-83-4
Molecular Weight (g/mol)	197.193
MDL Number	MFCD00006920
SMILES	C1=CC2=C3C(=C1)C(=O)NC(=O)C3=CC=C2
Synonym	1,8-naphthalimide,naphthalimide,1h-benz de isoquinoline-1,3 2h-dione,1h-benzo de isoquinoline-1,3 2h-dione,1,8-naphthalenedicarboximide,benzo de isoquinoline-1,3-dione,unii-gi0tv19gbn,naphthalene-1,8-dicarboximide,gi0tv19gbn
IUPAC Name	benzo[de]isoquinoline-1,3-dione
InChI Key	XJHABGPPCLHLLV-UHFFFAOYSA-N
Molecular Formula	C12H7NO2

7-Bromo-1-hydroxyisoquinoline, 97%

CAS: 223671-15-6 Molecular Formula: C9H6BrNO Molecular Weight (g/mol): 224.057 MDL Number: MFCD02093963 InChI Key: DSOKREQUHLPVFR-UHFFFAOYSA-N PubChem CID: 11276133 IUPAC Name: 7-bromo-2H-isoquinolin-1-one SMILES: C1=CC(=CC2=C1C=CNC2=O)Br

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Specifications

PubChem CID	11276133
CAS	223671-15-6
Molecular Weight (g/mol)	224.057
MDL Number	MFCD02093963
SMILES	C1=CC(=CC2=C1C=CNC2=O)Br
IUPAC Name	7-bromo-2H-isoquinolin-1-one
InChI Key	DSOKREQUHLPVFR-UHFFFAOYSA-N
Molecular Formula	C9H6BrNO

4-Amino-1,8-naphthalimide, 95%

CAS: 1742-95-6 Molecular Formula: C12H8N2O2 Molecular Weight (g/mol): 212.21 MDL Number: MFCD00006921 InChI Key: SSMIFVHARFVINF-UHFFFAOYSA-N Synonym: 4-amino-1,8-naphthalimide,4-aminonaphthalimide,6-amino-benzo de isoquinoline-1,3-dione,6-amino-1h-benzo de isoquinoline-1,3 2h-dione,4-aminonaphthalene-1,8-dicarboximide,naphthalimide, 4-amino,dfp 1,1h-benz de isoquinoline-1,3 2h-dione, 6-amino,6-aminobenzo de isoquinoline-1,3-dione,parp inhibitor v, 4-ani PubChem CID: 1720 ChEBI: CHEBI:40071 SMILES: NC1=C2C=CC=C3C(=O)NC(=O)C(C=C1)=C23

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Specifications

PubChem CID	1720
CAS	1742-95-6
Molecular Weight (g/mol)	212.21
ChEBI	CHEBI:40071
MDL Number	MFCD00006921
SMILES	NC1=C2C=CC=C3C(=O)NC(=O)C(C=C1)=C23
Synonym	4-amino-1,8-naphthalimide,4-aminonaphthalimide,6-amino-benzo de isoquinoline-1,3-dione,6-amino-1h-benzo de isoquinoline-1,3 2h-dione,4-aminonaphthalene-1,8-dicarboximide,naphthalimide, 4-amino,dfp 1,1h-benz de isoquinoline-1,3 2h-dione, 6-amino,6-aminobenzo de isoquinoline-1,3-dione,parp inhibitor v, 4-ani
InChI Key	SSMIFVHARFVINF-UHFFFAOYSA-N
Molecular Formula	C12H8N2O2

3-Hydroxyisoquinoline, 99%

CAS: 7651-81-2 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.161 MDL Number: MFCD00075524 InChI Key: GYPOFOQUZZUVQL-UHFFFAOYSA-N Synonym: 3-hydroxyisoquinoline,isoquinolin-3-ol,isoquinolin-3 2h-one,3-isoquinolinol,2,3-dihydroisoquinolin-3-one,3 2h-isoquinolinone,2h-3-isoquinolone,zlchem 163,3-hydroxy-isoquinoline,3-isoquinolinol 9ci PubChem CID: 2736554 IUPAC Name: 2H-isoquinolin-3-one SMILES: C1=CC2=CC(=O)NC=C2C=C1

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Specifications

PubChem CID	2736554
CAS	7651-81-2
Molecular Weight (g/mol)	145.161
MDL Number	MFCD00075524
SMILES	C1=CC2=CC(=O)NC=C2C=C1
Synonym	3-hydroxyisoquinoline,isoquinolin-3-ol,isoquinolin-3 2h-one,3-isoquinolinol,2,3-dihydroisoquinolin-3-one,3 2h-isoquinolinone,2h-3-isoquinolone,zlchem 163,3-hydroxy-isoquinoline,3-isoquinolinol 9ci
IUPAC Name	2H-isoquinolin-3-one
InChI Key	GYPOFOQUZZUVQL-UHFFFAOYSA-N
Molecular Formula	C9H7NO

3,4,9,10-Perylenetetracarboxylic diimide

CAS: 81-33-4 Molecular Formula: C24H10N2O4 Molecular Weight (g/mol): 390.354 MDL Number: MFCD00024144 InChI Key: KJOLVZJFMDVPGB-UHFFFAOYSA-N Synonym: perylimid,3,4,9,10-perylenetetracarboxylic diimide,perylenediimide,3,4,9,10-perylenetetracarboxylic acid diimide,perylene-3,4:9,10-tetracarboxydiimide,unii-63nli8842l,anthra 2,1,9-def:6,5,10-d'e'f' diisoquinoline-1,3,8,10 2h,9h-tetrone,anthra 2,1,9-def:6,5,10-d'e'f' diisoquinoline-1,3,8,10 2h,9h-tetraone,isoquino 4',5',6':6,5,10 anthra 2,1,9-def isoquinoline-1,3,8,10 2h,9h-tetrone PubChem CID: 66475 ChEBI: CHEBI:52753 SMILES: C1=CC2=C3C(=CC=C4C3=C1C5=C6C4=CC=C7C6=C(C=C5)C(=O)NC7=O)C(=O)NC2=O

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Specifications

PubChem CID	66475
CAS	81-33-4
Molecular Weight (g/mol)	390.354
ChEBI	CHEBI:52753
MDL Number	MFCD00024144
SMILES	C1=CC2=C3C(=CC=C4C3=C1C5=C6C4=CC=C7C6=C(C=C5)C(=O)NC7=O)C(=O)NC2=O
Synonym	perylimid,3,4,9,10-perylenetetracarboxylic diimide,perylenediimide,3,4,9,10-perylenetetracarboxylic acid diimide,perylene-3,4:9,10-tetracarboxydiimide,unii-63nli8842l,anthra 2,1,9-def:6,5,10-d'e'f' diisoquinoline-1,3,8,10 2h,9h-tetrone,anthra 2,1,9-def:6,5,10-d'e'f' diisoquinoline-1,3,8,10 2h,9h-tetraone,isoquino 4',5',6':6,5,10 anthra 2,1,9-def isoquinoline-1,3,8,10 2h,9h-tetrone
InChI Key	KJOLVZJFMDVPGB-UHFFFAOYSA-N
Molecular Formula	C24H10N2O4

Naltrexone hydrochloride, Thermo Scientific Chemicals

CAS: 16676-29-2 Molecular Formula: C20H24ClNO4 Molecular Weight (g/mol): 377.865 MDL Number: MFCD00069324 InChI Key: RHBRMCOKKKZVRY-ITLPAZOVSA-N Synonym: naltrexone hydrochloride,naltrexone hcl,trexan,depade,antaxone,revia,nalorex,unii-z6375yw9sf,nemexin PubChem CID: 5485201 IUPAC Name: (4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride SMILES: C1CC1CN2CCC34C5C(=O)CCC3(C2CC6=C4C(=C(C=C6)O)O5)O.Cl

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Specifications

PubChem CID	5485201
CAS	16676-29-2
Molecular Weight (g/mol)	377.865
MDL Number	MFCD00069324
SMILES	C1CC1CN2CCC34C5C(=O)CCC3(C2CC6=C4C(=C(C=C6)O)O5)O.Cl
Synonym	naltrexone hydrochloride,naltrexone hcl,trexan,depade,antaxone,revia,nalorex,unii-z6375yw9sf,nemexin
IUPAC Name	(4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride
InChI Key	RHBRMCOKKKZVRY-ITLPAZOVSA-N
Molecular Formula	C20H24ClNO4

Naloxone Hydrocloride, MP Biomedicals™

CAS: 357-08-4 Molecular Formula: C19H22ClNO4 Molecular Weight (g/mol): 363.84 InChI Key: RGPDIGOSVORSAK-STHHAXOLSA-N Synonym: Narcan,EN-1530,(5α)-4,5-Epoxy-3,14-dihydroxy-17-(2-propenyl)morphinan-6-one hydrochloride,17-allyl-4,5α- epoxy-3,14-dihydroxymorphinan-6-one hydrochloride

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Specifications

CAS	357-08-4
Molecular Weight (g/mol)	363.84
Synonym	Narcan,EN-1530,(5α)-4,5-Epoxy-3,14-dihydroxy-17-(2-propenyl)morphinan-6-one hydrochloride,17-allyl-4,5α- epoxy-3,14-dihydroxymorphinan-6-one hydrochloride
InChI Key	RGPDIGOSVORSAK-STHHAXOLSA-N
Molecular Formula	C19H22ClNO4

Norlaudanosine Hydrochloride 98.0+%, TCI America™

CAS: 6429-04-5 Molecular Formula: C20H26ClNO4 Molecular Weight (g/mol): 379.88 MDL Number: MFCD00035267 InChI Key: VMPLLPIDRGXFTQ-UHFFFAOYNA-N Synonym: Tetrahydropapaverine Hydrochloride, 1-(3,4-Dimethoxybenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline Hydrochloride PubChem CID: 16667431 IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline;hydrochloride SMILES: COC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2)OC)OC)OC.Cl

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Specifications

PubChem CID	16667431
CAS	6429-04-5
Molecular Weight (g/mol)	379.88
MDL Number	MFCD00035267
SMILES	COC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2)OC)OC)OC.Cl
Synonym	Tetrahydropapaverine Hydrochloride, 1-(3,4-Dimethoxybenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline Hydrochloride
IUPAC Name	1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline;hydrochloride
InChI Key	VMPLLPIDRGXFTQ-UHFFFAOYNA-N
Molecular Formula	C20H26ClNO4

Palonosetron Hydrochloride 98.0+%, TCI America™

CAS: 135729-62-3 Molecular Formula: C19H25ClN2O Molecular Weight (g/mol): 332.87 MDL Number: MFCD00939524 InChI Key: OLDRWYVIKMSFFB-KPVRICSOSA-N PubChem CID: 6918303 ChEBI: CHEBI:85157 IUPAC Name: hydrogen (5R)-3-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-3-azatricyclo[7.3.1.0⁵,¹³]trideca-1(13),9,11-trien-2-one chloride SMILES: [H+].[Cl-].O=C1N(C[C@@H]2CCCC3=CC=CC1=C23)[C@@H]1CN2CCC1CC2

Pricing and Availability
Specifications

PubChem CID	6918303
CAS	135729-62-3
Molecular Weight (g/mol)	332.87
ChEBI	CHEBI:85157
MDL Number	MFCD00939524
SMILES	[H+].[Cl-].O=C1N(C[C@@H]2CCCC3=CC=CC1=C23)[C@@H]1CN2CCC1CC2
IUPAC Name	hydrogen (5R)-3-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-3-azatricyclo[7.3.1.0⁵,¹³]trideca-1(13),9,11-trien-2-one chloride
InChI Key	OLDRWYVIKMSFFB-KPVRICSOSA-N
Molecular Formula	C19H25ClN2O

PubChem CID	66491
CAS	81-83-4
Molecular Weight (g/mol)	197.193
MDL Number	MFCD00006920
SMILES	C1=CC2=C3C(=C1)C(=O)NC(=O)C3=CC=C2
Synonym	1,8-naphthalimide,naphthalimide,1h-benz de isoquinoline-1,3 2h-dione,1h-benzo de isoquinoline-1,3 2h-dione,1,8-naphthalenedicarboximide,benzo de isoquinoline-1,3-dione,unii-gi0tv19gbn,naphthalene-1,8-dicarboximide,gi0tv19gbn
IUPAC Name	benzo[de]isoquinoline-1,3-dione
InChI Key	XJHABGPPCLHLLV-UHFFFAOYSA-N
Molecular Formula	C12H7NO2

Palmitoleic acid, >99%, MP Biomedicals™

CAS: 61-25-6 Molecular Formula: C20H22ClNO4 Molecular Weight (g/mol): 375.849 InChI Key: UOTMYNBWXDUBNX-UHFFFAOYSA-N Synonym: papaverine hydrochloride,cardiospan,cardoverina,dispamil,drapavel,forpavin,papalease,papaversan,pavatest,paverolan PubChem CID: 6084 IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline;hydrochloride SMILES: COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC.Cl

Pricing and Availability
Specifications

PubChem CID	6084
CAS	61-25-6
Molecular Weight (g/mol)	375.849
SMILES	COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC.Cl
Synonym	papaverine hydrochloride,cardiospan,cardoverina,dispamil,drapavel,forpavin,papalease,papaversan,pavatest,paverolan
IUPAC Name	1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline;hydrochloride
InChI Key	UOTMYNBWXDUBNX-UHFFFAOYSA-N
Molecular Formula	C20H22ClNO4

(4aS,8aR)-2-Benzoyloctahydro-6(2H)-isoquinolinone 90.0+%, TCI America™

CAS: 52390-26-8 Molecular Formula: C16H19NO2 Molecular Weight (g/mol): 257.33 MDL Number: MFCD08276277 InChI Key: OSZFDJVZOKTWRW-UHFFFAOYNA-N PubChem CID: 12262835 IUPAC Name: 2-benzoyl-decahydroisoquinolin-6-one SMILES: O=C(N1CCC2CC(=O)CCC2C1)C1=CC=CC=C1

Pricing and Availability
Specifications

PubChem CID	12262835
CAS	52390-26-8
Molecular Weight (g/mol)	257.33
MDL Number	MFCD08276277
SMILES	O=C(N1CCC2CC(=O)CCC2C1)C1=CC=CC=C1
IUPAC Name	2-benzoyl-decahydroisoquinolin-6-one
InChI Key	OSZFDJVZOKTWRW-UHFFFAOYNA-N
Molecular Formula	C16H19NO2

Isoquinolines and derivatives

Isoquinolines and derivatives

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