[(1S)-1-(4-nitrophenyl)-2-oxidanylidene-2-phenyl-ethyl] 2-[(4-bromophenyl)carbonylamino]ethanoate

Systemtic Name: [(1S)-1-(4-nitrophenyl)-2-oxidanylidene-2-phenyl-ethyl] 2-[(4-bromophenyl)carbonylamino]ethanoate Openeye Name: [(1S)-1-(4-nitrophenyl)-2-oxo-2-phenyl-ethyl] 2-[(4-bromobenzoyl)amino]acetate CAS Name: 2-[[(4-bromophenyl)-oxomethyl]amino]acetic acid [(1S)-1-(4-nitrophenyl)-2-oxo-2-phenylethyl] ester IUPAC Name: [(1S)-1-(4-nitrophenyl)-2-oxo-2-phenylethyl] 2-[(4-bromobenzoyl)amino]acetate Traditional Name: 2-[(4-bromobenzoyl)amino]acetic acid [(1S)-2-keto-1-(4-nitrophenyl)-2-phenyl-ethyl] ester Formula: C23H17BrN2O6 MolecularWeight: 497.29488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C(C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)CNC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)[C@H](C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)CNC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C23H17BrN2O6/c24-18-10-6-17(7-11-18)23(29)25-14-20(27)32-22(21(28)15-4-2-1-3-5-15)16-8-12-19(13-9-16)26(30)31/h1-13,22H,14H2,(H,25,29)/t22-/m0/s1