(4-oxidanylidene-4-phenyl-butyl) 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate

Systemtic Name: (4-oxidanylidene-4-phenyl-butyl) 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate Openeye Name: (4-oxo-4-phenyl-butyl) 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate CAS Name: 2-(3-chlorophenyl)-3-methyl-4-quinolinecarboxylic acid (4-oxo-4-phenylbutyl) ester IUPAC Name: (4-oxo-4-phenylbutyl) 2-(3-chlorophenyl)-3-methylquinoline-4-carboxylate Traditional Name: 2-(3-chlorophenyl)-3-methyl-cinchoninic acid (4-keto-4-phenyl-butyl) ester Formula: C27H22ClNO3 MolecularWeight: 443.92148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)OCCCC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)OCCCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H22ClNO3/c1-18-25(27(31)32-16-8-15-24(30)19-9-3-2-4-10-19)22-13-5-6-14-23(22)29-26(18)20-11-7-12-21(28)17-20/h2-7,9-14,17H,8,15-16H2,1H3