1-tert-butyl-5-nitro-3-oxidanidyl-benzimidazol-3-ium

Systemtic Name: 1-tert-butyl-5-nitro-3-oxidanidyl-benzimidazol-3-ium Openeye Name: 1-tert-butyl-5-nitro-3-oxido-benzimidazol-3-ium CAS Name: 1-tert-butyl-5-nitro-3-oxidobenzimidazol-3-ium IUPAC Name: 1-tert-butyl-5-nitro-3-oxidobenzimidazol-3-ium Traditional Name: 1-tert-butyl-5-nitro-3-oxido-benzimidazol-3-ium Formula: C11H13N3O3 MolecularWeight: 235.23922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=[N+](C2=C1C=CC(=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

CC(C)(C)N1C=[N+](C2=C1C=CC(=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C11H13N3O3/c1-11(2,3)12-7-13(15)10-6-8(14(16)17)4-5-9(10)12/h4-7H,1-3H3