2-[(4-carboxyphenyl)methyl]-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxylic acid

Systemtic Name: 2-[(4-carboxyphenyl)methyl]-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxylic acid Openeye Name: 2-[(4-carboxyphenyl)methyl]-1-oxo-4-phenyl-isoquinoline-3-carboxylic acid CAS Name: 2-[(4-carboxyphenyl)methyl]-1-oxo-4-phenyl-3-isoquinolinecarboxylic acid IUPAC Name: 2-[(4-carboxyphenyl)methyl]-1-oxo-4-phenylisoquinoline-3-carboxylic acid Traditional Name: 2-(4-carboxybenzyl)-1-keto-4-phenyl-isoquinoline-3-carboxylic acid Formula: C24H17NO5 MolecularWeight: 399.39548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(C(=O)C3=CC=CC=C32)CC4=CC=C(C=C4)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(C(=O)C3=CC=CC=C32)CC4=CC=C(C=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C24H17NO5/c26-22-19-9-5-4-8-18(19)20(16-6-2-1-3-7-16)21(24(29)30)25(22)14-15-10-12-17(13-11-15)23(27)28/h1-13H,14H2,(H,27,28)(H,29,30)