[2-(4-methylphenyl)-2-oxidanylidene-ethyl] 3,6,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-ethyl] 3,6,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: [2-oxo-2-(p-tolyl)ethyl] 3,6,8-trimethyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 3,6,8-trimethyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid [2-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] 3,6,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 3,6,8-trimethyl-2-(p-tolyl)cinchoninic acid [2-keto-2-(p-tolyl)ethyl] ester Formula: C29H27NO3 MolecularWeight: 437.52958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2C)C(=O)OCC(=O)C4=CC=C(C=C4)C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2C)C(=O)OCC(=O)C4=CC=C(C=C4)C)C)C

InChI

InChI=1S/C29H27NO3/c1-17-6-10-22(11-7-17)25(31)16-33-29(32)26-21(5)28(23-12-8-18(2)9-13-23)30-27-20(4)14-19(3)15-24(26)27/h6-15H,16H2,1-5H3