(3-methylphenyl) 6-bromanyl-2-(4-chlorophenyl)quinoline-4-carboxylate

Systemtic Name: (3-methylphenyl) 6-bromanyl-2-(4-chlorophenyl)quinoline-4-carboxylate Openeye Name: m-tolyl 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate CAS Name: 6-bromo-2-(4-chlorophenyl)-4-quinolinecarboxylic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 6-bromo-2-(4-chlorophenyl)quinoline-4-carboxylate Traditional Name: 6-bromo-2-(4-chlorophenyl)cinchoninic acid m-tolyl ester Formula: C23H15BrClNO2 MolecularWeight: 452.7277

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=CC=C1)OC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H15BrClNO2/c1-14-3-2-4-18(11-14)28-23(27)20-13-22(15-5-8-17(25)9-6-15)26-21-10-7-16(24)12-19(20)21/h2-13H,1H3