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

Systemtic Name: methyl 6,7-dimethoxy-1-oxidanylidene-2-(4-phenylmethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Openeye Name: methyl 2-(4-benzyloxyphenyl)-6,7-dimethoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate CAS Name: 6,7-dimethoxy-1-oxo-2-(4-phenylmethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 6,7-dimethoxy-1-oxo-2-(4-phenylmethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-1-keto-6,7-dimethoxy-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester Formula: C35H33NO9 MolecularWeight: 611.63782

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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)OCC5=CC=CC=C5)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)OCC5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C35H33NO9/c1-39-27-18-25-26(19-28(27)40-2)34(37)36(23-12-14-24(15-13-23)45-20-21-10-8-7-9-11-21)32(35(38)44-6)31(25)22-16-29(41-3)33(43-5)30(17-22)42-4/h7-19H,20H2,1-6H3