methyl 2-(4-azanyl-3-methoxy-phenyl)-6,7-dimethoxy-1-oxidanylidene-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate

Systemtic Name: methyl 2-(4-azanyl-3-methoxy-phenyl)-6,7-dimethoxy-1-oxidanylidene-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Openeye Name: methyl 2-(4-amino-3-methoxy-phenyl)-6,7-dimethoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate CAS Name: 2-(4-amino-3-methoxyphenyl)-6,7-dimethoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-amino-3-methoxyphenyl)-6,7-dimethoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Traditional Name: 2-(4-amino-3-methoxy-phenyl)-1-keto-6,7-dimethoxy-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester Formula: C29H30N2O9 MolecularWeight: 550.5565

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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)OC)OC)C4=CC(=C(C=C4)N)OC)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C29H30N2O9/c1-34-20-12-16(8-9-19(20)30)31-26(29(33)40-7)25(15-10-23(37-4)27(39-6)24(11-15)38-5)17-13-21(35-2)22(36-3)14-18(17)28(31)32/h8-14H,30H2,1-7H3