[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl] 4-nitrobenzoate

Systemtic Name: [2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl] 4-nitrobenzoate Openeye Name: [2-(ethoxycarbonylamino)-2-oxo-ethyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-(ethoxycarbonylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethoxycarbonylamino)-2-oxoethyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-(carbethoxyamino)-2-keto-ethyl] ester Formula: C12H12N2O7 MolecularWeight: 296.23288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O7/c1-2-20-12(17)13-10(15)7-21-11(16)8-3-5-9(6-4-8)14(18)19/h3-6H,2,7H2,1H3,(H,13,15,17)