[4-(phenylmethyl)phenyl] 2-(4-bromophenyl)-6,8-dimethyl-quinoline-4-carboxylate

Systemtic Name: [4-(phenylmethyl)phenyl] 2-(4-bromophenyl)-6,8-dimethyl-quinoline-4-carboxylate Openeye Name: (4-benzylphenyl) 2-(4-bromophenyl)-6,8-dimethyl-quinoline-4-carboxylate CAS Name: 2-(4-bromophenyl)-6,8-dimethyl-4-quinolinecarboxylic acid [4-(phenylmethyl)phenyl] ester IUPAC Name: (4-benzylphenyl) 2-(4-bromophenyl)-6,8-dimethylquinoline-4-carboxylate Traditional Name: 2-(4-bromophenyl)-6,8-dimethyl-cinchoninic acid (4-benzylphenyl) ester Formula: C31H24BrNO2 MolecularWeight: 522.43176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)Br)C(=O)OC4=CC=C(C=C4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)Br)C(=O)OC4=CC=C(C=C4)CC5=CC=CC=C5)C

InChI

InChI=1S/C31H24BrNO2/c1-20-16-21(2)30-27(17-20)28(19-29(33-30)24-10-12-25(32)13-11-24)31(34)35-26-14-8-23(9-15-26)18-22-6-4-3-5-7-22/h3-17,19H,18H2,1-2H3