[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 2-(4-chlorophenyl)-3,6-dimethyl-quinoline-4-carboxylate

Systemtic Name: [2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 2-(4-chlorophenyl)-3,6-dimethyl-quinoline-4-carboxylate Openeye Name: [2-(3-methoxyphenyl)-2-oxo-ethyl] 2-(4-chlorophenyl)-3,6-dimethyl-quinoline-4-carboxylate CAS Name: 2-(4-chlorophenyl)-3,6-dimethyl-4-quinolinecarboxylic acid [2-(3-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methoxyphenyl)-2-oxoethyl] 2-(4-chlorophenyl)-3,6-dimethylquinoline-4-carboxylate Traditional Name: 2-(4-chlorophenyl)-3,6-dimethyl-cinchoninic acid [2-keto-2-(3-methoxyphenyl)ethyl] ester Formula: C27H22ClNO4 MolecularWeight: 459.92088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(N=C2C=C1)C3=CC=C(C=C3)Cl)C)C(=O)OCC(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC2=C(C(=C(N=C2C=C1)C3=CC=C(C=C3)Cl)C)C(=O)OCC(=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C27H22ClNO4/c1-16-7-12-23-22(13-16)25(17(2)26(29-23)18-8-10-20(28)11-9-18)27(31)33-15-24(30)19-5-4-6-21(14-19)32-3/h4-14H,15H2,1-3H3