(2-oxidanylidene-1,2-diphenyl-ethyl) 2-(3-bromophenyl)quinoline-4-carboxylate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) 2-(3-bromophenyl)quinoline-4-carboxylate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) 2-(3-bromophenyl)quinoline-4-carboxylate CAS Name: 2-(3-bromophenyl)-4-quinolinecarboxylic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) 2-(3-bromophenyl)quinoline-4-carboxylate Traditional Name: 2-(3-bromophenyl)cinchoninic acid desyl ester Formula: C30H20BrNO3 MolecularWeight: 522.3887

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)OC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)Br

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)OC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)Br

InChI

InChI=1S/C30H20BrNO3/c31-23-15-9-14-22(18-23)27-19-25(24-16-7-8-17-26(24)32-27)30(34)35-29(21-12-5-2-6-13-21)28(33)20-10-3-1-4-11-20/h1-19,29H