ethyl 2-[[(3-nitrophenyl)carbonylamino]methyl-nitroso-amino]ethanoate

Systemtic Name: ethyl 2-[[(3-nitrophenyl)carbonylamino]methyl-nitroso-amino]ethanoate Openeye Name: ethyl 2-[[(3-nitrobenzoyl)amino]methyl-nitroso-amino]acetate CAS Name: 2-[[[(3-nitrophenyl)-oxomethyl]amino]methyl-nitrosoamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(3-nitrobenzoyl)amino]methyl-nitrosoamino]acetate Traditional Name: 2-[[(3-nitrobenzoyl)amino]methyl-nitroso-amino]acetic acid ethyl ester Formula: C12H14N4O6 MolecularWeight: 310.26276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])N=O

Isomeric SMILES

CCOC(=O)CN(CNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])N=O

InChI

InChI=1S/C12H14N4O6/c1-2-22-11(17)7-15(14-19)8-13-12(18)9-4-3-5-10(6-9)16(20)21/h3-6H,2,7-8H2,1H3,(H,13,18)