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

Systemtic Name: [4-(2-phenylpropan-2-yl)phenyl] 6,8-dimethyl-2-thiophen-2-yl-quinoline-4-carboxylate Openeye Name: [4-(1-methyl-1-phenyl-ethyl)phenyl] 6,8-dimethyl-2-(2-thienyl)quinoline-4-carboxylate CAS Name: 6,8-dimethyl-2-thiophen-2-yl-4-quinolinecarboxylic acid [4-(2-phenylpropan-2-yl)phenyl] ester IUPAC Name: [4-(2-phenylpropan-2-yl)phenyl] 6,8-dimethyl-2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 6,8-dimethyl-2-(2-thienyl)cinchoninic acid (4-cumylphenyl) ester Formula: C31H27NO2S MolecularWeight: 477.61658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CS3)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=CC=CS3)C(=O)OC4=CC=C(C=C4)C(C)(C)C5=CC=CC=C5)C

InChI

InChI=1S/C31H27NO2S/c1-20-17-21(2)29-25(18-20)26(19-27(32-29)28-11-8-16-35-28)30(33)34-24-14-12-23(13-15-24)31(3,4)22-9-6-5-7-10-22/h5-19H,1-4H3