5-nitro-3-oxidanidyl-1-oxidanyl-2H-benzimidazol-3-ium-4-imine

Systemtic Name: 5-nitro-3-oxidanidyl-1-oxidanyl-2H-benzimidazol-3-ium-4-imine Openeye Name: 1-hydroxy-5-nitro-3-oxido-2H-benzimidazol-3-ium-4-imine CAS Name: 1-hydroxy-5-nitro-3-oxido-2H-benzimidazol-3-ium-4-imine IUPAC Name: 1-hydroxy-5-nitro-3-oxido-2H-benzimidazol-3-ium-4-imine Traditional Name: (1-hydroxy-5-nitro-3-oxido-2H-benzimidazol-3-ium-4-ylidene)amine Formula: C7H6N4O4 MolecularWeight: 210.14694

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Descriptors Computed from Structure

Canonical SMILES:

C1N(C2=CC=C(C(=N)C2=[N+]1[O-])[N+](=O)[O-])O

Isomeric SMILES

C1N(C2=CC=C(C(=N)C2=[N+]1[O-])[N+](=O)[O-])O

InChI

InChI=1S/C7H6N4O4/c8-6-4(11(14)15)1-2-5-7(6)10(13)3-9(5)12/h1-2,8,12H,3H2