[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl] 2-[(2-phenylquinolin-4-yl)carbonylamino]benzoate

Systemtic Name: [2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl] 2-[(2-phenylquinolin-4-yl)carbonylamino]benzoate Openeye Name: [2-(2-bromoanilino)-2-oxo-ethyl] 2-[(2-phenylquinoline-4-carbonyl)amino]benzoate CAS Name: 2-[[oxo-(2-phenyl-4-quinolinyl)methyl]amino]benzoic acid [2-(2-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-bromoanilino)-2-oxoethyl] 2-[(2-phenylquinoline-4-carbonyl)amino]benzoate Traditional Name: 2-[(2-phenylquinoline-4-carbonyl)amino]benzoic acid [2-(2-bromoanilino)-2-keto-ethyl] ester Formula: C31H22BrN3O4 MolecularWeight: 580.42808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=CC=C4C(=O)OCC(=O)NC5=CC=CC=C5Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=CC=C4C(=O)OCC(=O)NC5=CC=CC=C5Br

InChI

InChI=1S/C31H22BrN3O4/c32-24-14-6-9-17-27(24)34-29(36)19-39-31(38)22-13-5-8-16-26(22)35-30(37)23-18-28(20-10-2-1-3-11-20)33-25-15-7-4-12-21(23)25/h1-18H,19H2,(H,34,36)(H,35,37)