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

Systemtic Name: methyl 2-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-1-oxidanylidene-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Openeye Name: methyl 2-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Traditional Name: 1-keto-6,7-dimethoxy-2-piperonyl-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester Formula: C30H29NO10 MolecularWeight: 563.55196

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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=CC5=C(C=C4)OCO5)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=CC(=C(C=C32)OC)OC)CC4=CC5=C(C=C4)OCO5)C(=O)OC

InChI

InChI=1S/C30H29NO10/c1-34-21-12-18-19(13-22(21)35-2)29(32)31(14-16-7-8-20-23(9-16)41-15-40-20)27(30(33)39-6)26(18)17-10-24(36-3)28(38-5)25(11-17)37-4/h7-13H,14-15H2,1-6H3