(1-oxidanylidene-1-phenyl-propan-2-yl) 2-(4-chlorophenyl)-8-methyl-quinoline-4-carboxylate

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 2-(4-chlorophenyl)-8-methyl-quinoline-4-carboxylate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 2-(4-chlorophenyl)-8-methyl-quinoline-4-carboxylate CAS Name: 2-(4-chlorophenyl)-8-methyl-4-quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 2-(4-chlorophenyl)-8-methylquinoline-4-carboxylate Traditional Name: 2-(4-chlorophenyl)-8-methyl-cinchoninic acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C26H20ClNO3 MolecularWeight: 429.8949

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C(=O)OC(C)C(=O)C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C(=O)OC(C)C(=O)C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H20ClNO3/c1-16-7-6-10-21-22(15-23(28-24(16)21)18-11-13-20(27)14-12-18)26(30)31-17(2)25(29)19-8-4-3-5-9-19/h3-15,17H,1-2H3