[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 8-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate

Systemtic Name: [1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 8-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(p-tolyl)ethyl] 2-(4-benzyloxyphenyl)-8-methyl-quinoline-4-carboxylate CAS Name: 8-methyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxylic acid [1-(4-methylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methylphenyl)-1-oxopropan-2-yl] 8-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-8-methyl-cinchoninic acid [2-keto-1-methyl-2-(p-tolyl)ethyl] ester Formula: C34H29NO4 MolecularWeight: 515.59836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC(=NC3=C2C=CC=C3C)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC(=NC3=C2C=CC=C3C)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C34H29NO4/c1-22-12-14-27(15-13-22)33(36)24(3)39-34(37)30-20-31(35-32-23(2)8-7-11-29(30)32)26-16-18-28(19-17-26)38-21-25-9-5-4-6-10-25/h4-20,24H,21H2,1-3H3