(2-azanyl-2-oxidanylidene-ethyl) 4-(methylamino)-3-nitro-benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 4-(methylamino)-3-nitro-benzoate Openeye Name: (2-amino-2-oxo-ethyl) 4-(methylamino)-3-nitro-benzoate CAS Name: 4-(methylamino)-3-nitrobenzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 4-(methylamino)-3-nitrobenzoate Traditional Name: 4-(methylamino)-3-nitro-benzoic acid (2-amino-2-keto-ethyl) ester Formula: C10H11N3O5 MolecularWeight: 253.21144

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)OCC(=O)N)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)OCC(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C10H11N3O5/c1-12-7-3-2-6(4-8(7)13(16)17)10(15)18-5-9(11)14/h2-4,12H,5H2,1H3,(H2,11,14)