[1-(4-chlorophenyl)-1-oxidanylidene-propan-2-yl] 3,7,8-trimethyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [1-(4-chlorophenyl)-1-oxidanylidene-propan-2-yl] 3,7,8-trimethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-(4-chlorophenyl)-1-methyl-2-oxo-ethyl] 3,7,8-trimethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 3,7,8-trimethyl-2-phenyl-4-quinolinecarboxylic acid [1-(4-chlorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-chlorophenyl)-1-oxopropan-2-yl] 3,7,8-trimethyl-2-phenylquinoline-4-carboxylate Traditional Name: 3,7,8-trimethyl-2-phenyl-cinchoninic acid [2-(4-chlorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C28H24ClNO3 MolecularWeight: 457.94806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C(=C2C=C1)C(=O)OC(C)C(=O)C3=CC=C(C=C3)Cl)C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C2=NC(=C(C(=C2C=C1)C(=O)OC(C)C(=O)C3=CC=C(C=C3)Cl)C)C4=CC=CC=C4)C

InChI

InChI=1S/C28H24ClNO3/c1-16-10-15-23-24(28(32)33-19(4)27(31)21-11-13-22(29)14-12-21)18(3)25(30-26(23)17(16)2)20-8-6-5-7-9-20/h5-15,19H,1-4H3