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

Systemtic Name: methyl 6,7-dimethoxy-1-oxidanylidene-2-(phenylmethyl)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Openeye Name: methyl 2-benzyl-6,7-dimethoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate CAS Name: 6,7-dimethoxy-1-oxo-2-(phenylmethyl)-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-benzyl-6,7-dimethoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Traditional Name: 2-benzyl-1-keto-6,7-dimethoxy-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester Formula: C29H29NO8 MolecularWeight: 519.54246

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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)CC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=CC(=C(C=C32)OC)OC)CC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C29H29NO8/c1-33-21-14-19-20(15-22(21)34-2)28(31)30(16-17-10-8-7-9-11-17)26(29(32)38-6)25(19)18-12-23(35-3)27(37-5)24(13-18)36-4/h7-15H,16H2,1-6H3