[2-(4-acetyloxyphenyl)-2-oxidanylidene-ethyl] 7-chloranyl-3,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: [2-(4-acetyloxyphenyl)-2-oxidanylidene-ethyl] 7-chloranyl-3,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: [2-(4-acetoxyphenyl)-2-oxo-ethyl] 7-chloro-3,8-dimethyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 7-chloro-3,8-dimethyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid [2-(4-acetyloxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetyloxyphenyl)-2-oxoethyl] 7-chloro-3,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 7-chloro-3,8-dimethyl-2-(p-tolyl)cinchoninic acid [2-(4-acetoxyphenyl)-2-keto-ethyl] ester Formula: C29H24ClNO5 MolecularWeight: 501.95756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=C3C=CC(=C(C3=N2)C)Cl)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=C3C=CC(=C(C3=N2)C)Cl)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C)C

InChI

InChI=1S/C29H24ClNO5/c1-16-5-7-21(8-6-16)27-18(3)26(23-13-14-24(30)17(2)28(23)31-27)29(34)35-15-25(33)20-9-11-22(12-10-20)36-19(4)32/h5-14H,15H2,1-4H3