[2-(2-bromophenyl)-2-oxidanylidene-ethyl] 2-[(3-nitrophenyl)carbonylamino]propanoate

Systemtic Name: [2-(2-bromophenyl)-2-oxidanylidene-ethyl] 2-[(3-nitrophenyl)carbonylamino]propanoate Openeye Name: [2-(2-bromophenyl)-2-oxo-ethyl] 2-[(3-nitrobenzoyl)amino]propanoate CAS Name: 2-[[(3-nitrophenyl)-oxomethyl]amino]propanoic acid [2-(2-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2-bromophenyl)-2-oxoethyl] 2-[(3-nitrobenzoyl)amino]propanoate Traditional Name: 2-[(3-nitrobenzoyl)amino]propionic acid [2-(2-bromophenyl)-2-keto-ethyl] ester Formula: C18H15BrN2O6 MolecularWeight: 435.2255

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)C1=CC=CC=C1Br)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)OCC(=O)C1=CC=CC=C1Br)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H15BrN2O6/c1-11(20-17(23)12-5-4-6-13(9-12)21(25)26)18(24)27-10-16(22)14-7-2-3-8-15(14)19/h2-9,11H,10H2,1H3,(H,20,23)