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

Systemtic Name: [4-(2-phenylpropan-2-yl)phenyl] 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Openeye Name: [4-(1-methyl-1-phenyl-ethyl)phenyl] 2-(4-benzyloxyphenyl)-3,6,8-trimethyl-quinoline-4-carboxylate CAS Name: 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxylic acid [4-(2-phenylpropan-2-yl)phenyl] ester IUPAC Name: [4-(2-phenylpropan-2-yl)phenyl] 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-3,6,8-trimethyl-cinchoninic acid (4-cumylphenyl) ester Formula: C41H37NO3 MolecularWeight: 591.73738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C(=O)OC5=CC=C(C=C5)C(C)(C)C6=CC=CC=C6)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C(=O)OC5=CC=C(C=C5)C(C)(C)C6=CC=CC=C6)C

InChI

InChI=1S/C41H37NO3/c1-27-24-28(2)38-36(25-27)37(40(43)45-35-22-18-33(19-23-35)41(4,5)32-14-10-7-11-15-32)29(3)39(42-38)31-16-20-34(21-17-31)44-26-30-12-8-6-9-13-30/h6-25H,26H2,1-5H3