[2-(4-methylphenyl)-2-oxidanylidene-ethyl] 2-(4-fluorophenyl)-6,8-dimethyl-quinoline-4-carboxylate

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-ethyl] 2-(4-fluorophenyl)-6,8-dimethyl-quinoline-4-carboxylate Openeye Name: [2-oxo-2-(p-tolyl)ethyl] 2-(4-fluorophenyl)-6,8-dimethyl-quinoline-4-carboxylate CAS Name: 2-(4-fluorophenyl)-6,8-dimethyl-4-quinolinecarboxylic acid [2-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] 2-(4-fluorophenyl)-6,8-dimethylquinoline-4-carboxylate Traditional Name: 2-(4-fluorophenyl)-6,8-dimethyl-cinchoninic acid [2-keto-2-(p-tolyl)ethyl] ester Formula: C27H22FNO3 MolecularWeight: 427.466883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=NC3=C(C=C(C=C23)C)C)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=NC3=C(C=C(C=C23)C)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H22FNO3/c1-16-4-6-20(7-5-16)25(30)15-32-27(31)23-14-24(19-8-10-21(28)11-9-19)29-26-18(3)12-17(2)13-22(23)26/h4-14H,15H2,1-3H3