2-(3-chlorophenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-3-carboxylic acid

Systemtic Name: 2-(3-chlorophenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-3-carboxylic acid Openeye Name: 2-(3-chlorophenyl)-1-oxo-3,4-dihydroisoquinoline-3-carboxylic acid CAS Name: 2-(3-chlorophenyl)-1-oxo-3,4-dihydroisoquinoline-3-carboxylic acid IUPAC Name: 2-(3-chlorophenyl)-1-oxo-3,4-dihydroisoquinoline-3-carboxylic acid Traditional Name: 2-(3-chlorophenyl)-1-keto-3,4-dihydroisoquinoline-3-carboxylic acid Formula: C16H12ClNO3 MolecularWeight: 301.72438

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(=O)C2=CC=CC=C21)C3=CC(=CC=C3)Cl)C(=O)O

Isomeric SMILES

C1C(N(C(=O)C2=CC=CC=C21)C3=CC(=CC=C3)Cl)C(=O)O

InChI

InChI=1S/C16H12ClNO3/c17-11-5-3-6-12(9-11)18-14(16(20)21)8-10-4-1-2-7-13(10)15(18)19/h1-7,9,14H,8H2,(H,20,21)