[2-(4-methylphenyl)-2-oxidanylidene-ethyl] 3,6-dimethyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-ethyl] 3,6-dimethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-oxo-2-(p-tolyl)ethyl] 3,6-dimethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 3,6-dimethyl-2-phenyl-4-quinolinecarboxylic acid [2-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] 3,6-dimethyl-2-phenylquinoline-4-carboxylate Traditional Name: 3,6-dimethyl-2-phenyl-cinchoninic acid [2-keto-2-(p-tolyl)ethyl] ester Formula: C27H23NO3 MolecularWeight: 409.47642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)COC(=O)C2=C3C=C(C=CC3=NC(=C2C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)COC(=O)C2=C3C=C(C=CC3=NC(=C2C)C4=CC=CC=C4)C

InChI

InChI=1S/C27H23NO3/c1-17-9-12-20(13-10-17)24(29)16-31-27(30)25-19(3)26(21-7-5-4-6-8-21)28-23-14-11-18(2)15-22(23)25/h4-15H,16H2,1-3H3