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

Systemtic Name: (4-bromophenyl)methyl 2-(4-phenylphenyl)quinoline-4-carboxylate Openeye Name: (4-bromophenyl)methyl 2-(4-phenylphenyl)quinoline-4-carboxylate CAS Name: 2-(4-phenylphenyl)-4-quinolinecarboxylic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 2-(4-phenylphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-phenylphenyl)cinchoninic acid (4-bromobenzyl) ester Formula: C29H20BrNO2 MolecularWeight: 494.3786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)OCC5=CC=C(C=C5)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)OCC5=CC=C(C=C5)Br

InChI

InChI=1S/C29H20BrNO2/c30-24-16-10-20(11-17-24)19-33-29(32)26-18-28(31-27-9-5-4-8-25(26)27)23-14-12-22(13-15-23)21-6-2-1-3-7-21/h1-18H,19H2