[2-(4-acetyloxyphenyl)-2-oxidanylidene-ethyl] 6-chloranyl-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: [2-(4-acetyloxyphenyl)-2-oxidanylidene-ethyl] 6-chloranyl-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: [2-(4-acetoxyphenyl)-2-oxo-ethyl] 6-chloro-3-methyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 6-chloro-3-methyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid [2-(4-acetyloxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetyloxyphenyl)-2-oxoethyl] 6-chloro-3-methyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 6-chloro-3-methyl-2-(p-tolyl)cinchoninic acid [2-(4-acetoxyphenyl)-2-keto-ethyl] ester Formula: C28H22ClNO5 MolecularWeight: 487.93098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=C3C=C(C=CC3=N2)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=C(C=CC3=N2)Cl)C(=O)OCC(=O)C4=CC=C(C=C4)OC(=O)C)C

InChI

InChI=1S/C28H22ClNO5/c1-16-4-6-20(7-5-16)27-17(2)26(23-14-21(29)10-13-24(23)30-27)28(33)34-15-25(32)19-8-11-22(12-9-19)35-18(3)31/h4-14H,15H2,1-3H3