(4-bromophenyl) 6-bromanyl-2-(4-bromophenyl)quinoline-4-carboxylate

Systemtic Name: (4-bromophenyl) 6-bromanyl-2-(4-bromophenyl)quinoline-4-carboxylate Openeye Name: (4-bromophenyl) 6-bromo-2-(4-bromophenyl)quinoline-4-carboxylate CAS Name: 6-bromo-2-(4-bromophenyl)-4-quinolinecarboxylic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) 6-bromo-2-(4-bromophenyl)quinoline-4-carboxylate Traditional Name: 6-bromo-2-(4-bromophenyl)cinchoninic acid (4-bromophenyl) ester Formula: C22H12Br3NO2 MolecularWeight: 562.04818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)OC4=CC=C(C=C4)Br)Br

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)OC4=CC=C(C=C4)Br)Br

InChI

InChI=1S/C22H12Br3NO2/c23-14-3-1-13(2-4-14)21-12-19(18-11-16(25)7-10-20(18)26-21)22(27)28-17-8-5-15(24)6-9-17/h1-12H