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

Systemtic Name: 3-(3-chlorophenyl)-2-methyl-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxylic acid Openeye Name: 3-(3-chlorophenyl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid CAS Name: 3-(3-chlorophenyl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid IUPAC Name: 3-(3-chlorophenyl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid Traditional Name: 3-(3-chlorophenyl)-1-keto-2-methyl-3,4-dihydroisoquinoline-4-carboxylic acid Formula: C17H14ClNO3 MolecularWeight: 315.75096

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC=CC=C2C1=O)C(=O)O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CN1C(C(C2=CC=CC=C2C1=O)C(=O)O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H14ClNO3/c1-19-15(10-5-4-6-11(18)9-10)14(17(21)22)12-7-2-3-8-13(12)16(19)20/h2-9,14-15H,1H3,(H,21,22)