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

Systemtic Name: [1-oxidanylidene-1-(phenethylamino)propan-2-yl] 2-[(3-nitrophenyl)carbonylamino]ethanoate Openeye Name: [1-methyl-2-oxo-2-(phenethylamino)ethyl] 2-[(3-nitrobenzoyl)amino]acetate CAS Name: 2-[[(3-nitrophenyl)-oxomethyl]amino]acetic acid [1-oxo-1-(phenethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(phenethylamino)propan-2-yl] 2-[(3-nitrobenzoyl)amino]acetate Traditional Name: 2-[(3-nitrobenzoyl)amino]acetic acid [2-keto-1-methyl-2-(phenethylamino)ethyl] ester Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CC=C1)OC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NCCC1=CC=CC=C1)OC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O6/c1-14(19(25)21-11-10-15-6-3-2-4-7-15)29-18(24)13-22-20(26)16-8-5-9-17(12-16)23(27)28/h2-9,12,14H,10-11,13H2,1H3,(H,21,25)(H,22,26)