2-(3-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxylic acid

Systemtic Name: 2-(3-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxylic acid Openeye Name: 2-(3-methoxyphenyl)-1-oxo-isoquinoline-4-carboxylic acid CAS Name: 2-(3-methoxyphenyl)-1-oxo-4-isoquinolinecarboxylic acid IUPAC Name: 2-(3-methoxyphenyl)-1-oxoisoquinoline-4-carboxylic acid Traditional Name: 1-keto-2-(3-methoxyphenyl)isoquinoline-4-carboxylic acid Formula: C17H13NO4 MolecularWeight: 295.28942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)O

InChI

InChI=1S/C17H13NO4/c1-22-12-6-4-5-11(9-12)18-10-15(17(20)21)13-7-2-3-8-14(13)16(18)19/h2-10H,1H3,(H,20,21)