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

Systemtic Name: methyl 6,7-diethoxy-2-(4-hydroxyphenyl)-1-oxidanylidene-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Openeye Name: methyl 6,7-diethoxy-2-(4-hydroxyphenyl)-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate CAS Name: 6,7-diethoxy-2-(4-hydroxyphenyl)-1-oxo-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 6,7-diethoxy-2-(4-hydroxyphenyl)-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Traditional Name: 6,7-diethoxy-2-(4-hydroxyphenyl)-1-keto-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester Formula: C30H31NO9 MolecularWeight: 549.56844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=C(N(C2=O)C3=CC=C(C=C3)O)C(=O)OC)C4=CC(=C(C(=C4)OC)OC)OC)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=C(N(C2=O)C3=CC=C(C=C3)O)C(=O)OC)C4=CC(=C(C(=C4)OC)OC)OC)OCC

InChI

InChI=1S/C30H31NO9/c1-7-39-22-15-20-21(16-23(22)40-8-2)29(33)31(18-9-11-19(32)12-10-18)27(30(34)38-6)26(20)17-13-24(35-3)28(37-5)25(14-17)36-4/h9-16,32H,7-8H2,1-6H3