[4-(2-phenylpropan-2-yl)phenyl] 2-(2,4-dichlorophenyl)-6,8-dimethyl-quinoline-4-carboxylate

Systemtic Name: [4-(2-phenylpropan-2-yl)phenyl] 2-(2,4-dichlorophenyl)-6,8-dimethyl-quinoline-4-carboxylate Openeye Name: [4-(1-methyl-1-phenyl-ethyl)phenyl] 2-(2,4-dichlorophenyl)-6,8-dimethyl-quinoline-4-carboxylate CAS Name: 2-(2,4-dichlorophenyl)-6,8-dimethyl-4-quinolinecarboxylic acid [4-(2-phenylpropan-2-yl)phenyl] ester IUPAC Name: [4-(2-phenylpropan-2-yl)phenyl] 2-(2,4-dichlorophenyl)-6,8-dimethylquinoline-4-carboxylate Traditional Name: 2-(2,4-dichlorophenyl)-6,8-dimethyl-cinchoninic acid (4-cumylphenyl) ester Formula: C33H27Cl2NO2 MolecularWeight: 540.47898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=C(C=C(C=C3)Cl)Cl)C(=O)OC4=CC=C(C=C4)C(C)(C)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=C(C=C(C=C3)Cl)Cl)C(=O)OC4=CC=C(C=C4)C(C)(C)C5=CC=CC=C5)C

InChI

InChI=1S/C33H27Cl2NO2/c1-20-16-21(2)31-27(17-20)28(19-30(36-31)26-15-12-24(34)18-29(26)35)32(37)38-25-13-10-23(11-14-25)33(3,4)22-8-6-5-7-9-22/h5-19H,1-4H3