(1-azanyl-1-oxidanylidene-propan-2-yl) 2-azanyl-5-nitro-benzoate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 2-azanyl-5-nitro-benzoate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 2-amino-5-nitro-benzoate CAS Name: 2-amino-5-nitrobenzoic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 2-amino-5-nitrobenzoate Traditional Name: 2-amino-5-nitro-benzoic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C10H11N3O5 MolecularWeight: 253.21144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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