[2-(4-chlorophenyl)-2-oxidanylidene-ethyl] 8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: [2-(4-chlorophenyl)-2-oxidanylidene-ethyl] 8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: [2-(4-chlorophenyl)-2-oxo-ethyl] 8-methyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 8-methyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid [2-(4-chlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-chlorophenyl)-2-oxoethyl] 8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 8-methyl-2-(p-tolyl)cinchoninic acid [2-(4-chlorophenyl)-2-keto-ethyl] ester Formula: C26H20ClNO3 MolecularWeight: 429.8949

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=CC=C3C)C(=C2)C(=O)OCC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=CC=C3C)C(=C2)C(=O)OCC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H20ClNO3/c1-16-6-8-18(9-7-16)23-14-22(21-5-3-4-17(2)25(21)28-23)26(30)31-15-24(29)19-10-12-20(27)13-11-19/h3-14H,15H2,1-2H3