1-oxidanylidene-2-phenyl-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid

Systemtic Name: 1-oxidanylidene-2-phenyl-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid Openeye Name: 1-oxo-2-phenyl-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid CAS Name: 1-oxo-2-phenyl-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid IUPAC Name: 1-oxo-2-phenyl-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid Traditional Name: 1-keto-2-phenyl-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid Formula: C25H21NO6 MolecularWeight: 431.43734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H21NO6/c1-30-19-13-15(14-20(31-2)23(19)32-3)21-17-11-7-8-12-18(17)24(27)26(22(21)25(28)29)16-9-5-4-6-10-16/h4-14H,1-3H3,(H,28,29)