2-(4-chlorophenyl)-1-oxidanylidene-isoquinoline-4-carboxylic acid

Systemtic Name: 2-(4-chlorophenyl)-1-oxidanylidene-isoquinoline-4-carboxylic acid Openeye Name: 2-(4-chlorophenyl)-1-oxo-isoquinoline-4-carboxylic acid CAS Name: 2-(4-chlorophenyl)-1-oxo-4-isoquinolinecarboxylic acid IUPAC Name: 2-(4-chlorophenyl)-1-oxoisoquinoline-4-carboxylic acid Traditional Name: 2-(4-chlorophenyl)-1-keto-isoquinoline-4-carboxylic acid Formula: C16H10ClNO3 MolecularWeight: 299.7085

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN(C2=O)C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN(C2=O)C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C16H10ClNO3/c17-10-5-7-11(8-6-10)18-9-14(16(20)21)12-3-1-2-4-13(12)15(18)19/h1-9H,(H,20,21)