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

Systemtic Name: (2-methoxy-2-oxidanylidene-ethyl) 4-azanyl-3-nitro-benzoate Openeye Name: (2-methoxy-2-oxo-ethyl) 4-amino-3-nitro-benzoate CAS Name: 4-amino-3-nitrobenzoic acid (2-methoxy-2-oxoethyl) ester IUPAC Name: (2-methoxy-2-oxoethyl) 4-amino-3-nitrobenzoate Traditional Name: 4-amino-3-nitro-benzoic acid (2-keto-2-methoxy-ethyl) ester Formula: C10H10N2O6 MolecularWeight: 254.1962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10N2O6/c1-17-9(13)5-18-10(14)6-2-3-7(11)8(4-6)12(15)16/h2-4H,5,11H2,1H3