[1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-[(3-bromophenyl)carbonylamino]ethanoate

Systemtic Name: [1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-[(3-bromophenyl)carbonylamino]ethanoate Openeye Name: [1-methyl-2-(3-nitroanilino)-2-oxo-ethyl] 2-[(3-bromobenzoyl)amino]acetate CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]acetic acid [1-(3-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-nitroanilino)-1-oxopropan-2-yl] 2-[(3-bromobenzoyl)amino]acetate Traditional Name: 2-[(3-bromobenzoyl)amino]acetic acid [2-keto-1-methyl-2-(3-nitroanilino)ethyl] ester Formula: C18H16BrN3O6 MolecularWeight: 450.24014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])OC(=O)CNC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])OC(=O)CNC(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C18H16BrN3O6/c1-11(17(24)21-14-6-3-7-15(9-14)22(26)27)28-16(23)10-20-18(25)12-4-2-5-13(19)8-12/h2-9,11H,10H2,1H3,(H,20,25)(H,21,24)