(3,4-dimethylphenyl) 2-(4-bromophenyl)quinoline-4-carboxylate

Systemtic Name: (3,4-dimethylphenyl) 2-(4-bromophenyl)quinoline-4-carboxylate Openeye Name: (3,4-dimethylphenyl) 2-(4-bromophenyl)quinoline-4-carboxylate CAS Name: 2-(4-bromophenyl)-4-quinolinecarboxylic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 2-(4-bromophenyl)quinoline-4-carboxylate Traditional Name: 2-(4-bromophenyl)cinchoninic acid (3,4-dimethylphenyl) ester Formula: C24H18BrNO2 MolecularWeight: 432.30922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C24H18BrNO2/c1-15-7-12-19(13-16(15)2)28-24(27)21-14-23(17-8-10-18(25)11-9-17)26-22-6-4-3-5-20(21)22/h3-14H,1-2H3