(4-bromophenyl)methyl 2-(4-chlorophenyl)quinoline-4-carboxylate

Systemtic Name: (4-bromophenyl)methyl 2-(4-chlorophenyl)quinoline-4-carboxylate Openeye Name: (4-bromophenyl)methyl 2-(4-chlorophenyl)quinoline-4-carboxylate CAS Name: 2-(4-chlorophenyl)-4-quinolinecarboxylic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 2-(4-chlorophenyl)quinoline-4-carboxylate Traditional Name: 2-(4-chlorophenyl)cinchoninic acid (4-bromobenzyl) ester Formula: C23H15BrClNO2 MolecularWeight: 452.7277

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)Cl)C(=O)OCC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)Cl)C(=O)OCC4=CC=C(C=C4)Br

InChI

InChI=1S/C23H15BrClNO2/c24-17-9-5-15(6-10-17)14-28-23(27)20-13-22(16-7-11-18(25)12-8-16)26-21-4-2-1-3-19(20)21/h1-13H,14H2