methyl 2-(4-aminophenyl)-4-(3,5-dimethoxy-4-methyl-phenyl)-1-oxidanylidene-7-phenylmethoxy-isoquinoline-3-carboxylate hydrochloride

Systemtic Name: methyl 2-(4-aminophenyl)-4-(3,5-dimethoxy-4-methyl-phenyl)-1-oxidanylidene-7-phenylmethoxy-isoquinoline-3-carboxylate hydrochloride Openeye Name: methyl 2-(4-aminophenyl)-7-benzyloxy-4-(3,5-dimethoxy-4-methyl-phenyl)-1-oxo-isoquinoline-3-carboxylate hydrochloride CAS Name: 2-(4-aminophenyl)-4-(3,5-dimethoxy-4-methylphenyl)-1-oxo-7-phenylmethoxy-3-isoquinolinecarboxylic acid methyl ester hydrochloride IUPAC Name: methyl 2-(4-aminophenyl)-4-(3,5-dimethoxy-4-methylphenyl)-1-oxo-7-phenylmethoxyisoquinoline-3-carboxylate hydrochloride Traditional Name: 2-(4-aminophenyl)-7-benzoxy-4-(3,5-dimethoxy-4-methyl-phenyl)-1-keto-isoquinoline-3-carboxylic acid methyl ester hydrochloride Formula: C33H31ClN2O6 MolecularWeight: 587.06204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1OC)C2=C(N(C(=O)C3=C2C=CC(=C3)OCC4=CC=CC=C4)C5=CC=C(C=C5)N)C(=O)OC)OC.Cl

Isomeric SMILES

CC1=C(C=C(C=C1OC)C2=C(N(C(=O)C3=C2C=CC(=C3)OCC4=CC=CC=C4)C5=CC=C(C=C5)N)C(=O)OC)OC.Cl

InChI

InChI=1S/C33H30N2O6.ClH/c1-20-28(38-2)16-22(17-29(20)39-3)30-26-15-14-25(41-19-21-8-6-5-7-9-21)18-27(26)32(36)35(31(30)33(37)40-4)24-12-10-23(34)11-13-24;/h5-18H,19,34H2,1-4H3;1H