2,2-dimethyl-7,7-dinitro-1-oxidanidyl-3-oxidanylidene-5,6-dihydrobenzimidazol-3-ium-4-one

Systemtic Name: 2,2-dimethyl-7,7-dinitro-1-oxidanidyl-3-oxidanylidene-5,6-dihydrobenzimidazol-3-ium-4-one Openeye Name: 2,2-dimethyl-7,7-dinitro-1-oxido-3-oxo-5,6-dihydrobenzimidazol-3-ium-4-one CAS Name: 2,2-dimethyl-7,7-dinitro-1-oxido-3-oxo-5,6-dihydrobenzimidazol-3-ium-4-one IUPAC Name: 2,2-dimethyl-7,7-dinitro-1-oxido-3-oxo-5,6-dihydrobenzimidazol-3-ium-4-one Traditional Name: 3-keto-2,2-dimethyl-7,7-dinitro-1-oxido-5,6-dihydrobenzimidazol-3-ium-4-one Formula: C9H10N4O7 MolecularWeight: 286.1983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(N(C2=C([N+]1=O)C(=O)CCC2([N+](=O)[O-])[N+](=O)[O-])[O-])C

Isomeric SMILES

CC1(N(C2=C([N+]1=O)C(=O)CCC2([N+](=O)[O-])[N+](=O)[O-])[O-])C

InChI

InChI=1S/C9H10N4O7/c1-8(2)10(15)6-5(14)3-4-9(12(17)18,13(19)20)7(6)11(8)16/h3-4H2,1-2H3