2-(4,5-dinitroimidazol-1-yl)ethanoate

Systemtic Name: 2-(4,5-dinitroimidazol-1-yl)ethanoate Openeye Name: 2-(4,5-dinitroimidazol-1-yl)acetate CAS Name: 2-(4,5-dinitro-1-imidazolyl)acetate IUPAC Name: 2-(4,5-dinitroimidazol-1-yl)acetate Traditional Name: 2-(4,5-dinitroimidazol-1-yl)acetate Formula: C5H3N4O6- MolecularWeight: 215.10052

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=C(N1CC(=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=NC(=C(N1CC(=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C5H4N4O6/c10-3(11)1-7-2-6-4(8(12)13)5(7)9(14)15/h2H,1H2,(H,10,11)/p-1