methyl 2-(4-aminophenyl)-7-methoxy-6-oxidanyl-1-oxidanylidene-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate hydrochloride

Systemtic Name: methyl 2-(4-aminophenyl)-7-methoxy-6-oxidanyl-1-oxidanylidene-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate hydrochloride Openeye Name: methyl 2-(4-aminophenyl)-6-hydroxy-7-methoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate hydrochloride CAS Name: 2-(4-aminophenyl)-6-hydroxy-7-methoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester hydrochloride IUPAC Name: methyl 2-(4-aminophenyl)-6-hydroxy-7-methoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate hydrochloride Traditional Name: 2-(4-aminophenyl)-6-hydroxy-1-keto-7-methoxy-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester hydrochloride Formula: C27H27ClN2O8 MolecularWeight: 542.96488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=CC(=C(C=C32)O)OC)C4=CC=C(C=C4)N)C(=O)OC.Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=CC(=C(C=C32)O)OC)C4=CC=C(C=C4)N)C(=O)OC.Cl

InChI

InChI=1S/C27H26N2O8.ClH/c1-33-20-13-18-17(12-19(20)30)23(14-10-21(34-2)25(36-4)22(11-14)35-3)24(27(32)37-5)29(26(18)31)16-8-6-15(28)7-9-16;/h6-13,30H,28H2,1-5H3;1H