[4-(2-methylbutan-2-yl)phenyl] 3,6,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: [4-(2-methylbutan-2-yl)phenyl] 3,6,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: [4-(1,1-dimethylpropyl)phenyl] 3,6,8-trimethyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 3,6,8-trimethyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid [4-(2-methylbutan-2-yl)phenyl] ester IUPAC Name: [4-(2-methylbutan-2-yl)phenyl] 3,6,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 3,6,8-trimethyl-2-(p-tolyl)cinchoninic acid (4-tert-amylphenyl) ester Formula: C31H33NO2 MolecularWeight: 451.59922

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OC(=O)C2=C(C(=NC3=C(C=C(C=C23)C)C)C4=CC=C(C=C4)C)C

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OC(=O)C2=C(C(=NC3=C(C=C(C=C23)C)C)C4=CC=C(C=C4)C)C

InChI

InChI=1S/C31H33NO2/c1-8-31(6,7)24-13-15-25(16-14-24)34-30(33)27-22(5)29(23-11-9-19(2)10-12-23)32-28-21(4)17-20(3)18-26(27)28/h9-18H,8H2,1-7H3