methyl 2-(2,3-dihydro-1H-inden-2-yl)-1-oxidanylidene-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate

Systemtic Name: methyl 2-(2,3-dihydro-1H-inden-2-yl)-1-oxidanylidene-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Openeye Name: methyl 2-indan-2-yl-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate CAS Name: 2-(2,3-dihydro-1H-inden-2-yl)-1-oxo-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(2,3-dihydro-1H-inden-2-yl)-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Traditional Name: 2-indan-2-yl-1-keto-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester Formula: C29H27NO6 MolecularWeight: 485.52778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=CC=CC=C32)C4CC5=CC=CC=C5C4)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=CC=CC=C32)C4CC5=CC=CC=C5C4)C(=O)OC

InChI

InChI=1S/C29H27NO6/c1-33-23-15-19(16-24(34-2)27(23)35-3)25-21-11-7-8-12-22(21)28(31)30(26(25)29(32)36-4)20-13-17-9-5-6-10-18(17)14-20/h5-12,15-16,20H,13-14H2,1-4H3