2,2-dimethyl-1-oxidanidyl-3-oxidanylidene-benzimidazol-3-ium-4,7-dione

Systemtic Name: 2,2-dimethyl-1-oxidanidyl-3-oxidanylidene-benzimidazol-3-ium-4,7-dione Openeye Name: 2,2-dimethyl-1-oxido-3-oxo-benzimidazol-3-ium-4,7-dione CAS Name: 2,2-dimethyl-1-oxido-3-oxobenzimidazol-3-ium-4,7-dione IUPAC Name: 2,2-dimethyl-1-oxido-3-oxobenzimidazol-3-ium-4,7-dione Traditional Name: 1-keto-2,2-dimethyl-3-oxido-benzimidazol-1-ium-4,7-quinone Formula: C9H8N2O4 MolecularWeight: 208.17082

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N(C2=C([N+]1=O)C(=O)C=CC2=O)[O-])C

Isomeric SMILES

CC1(N(C2=C([N+]1=O)C(=O)C=CC2=O)[O-])C

InChI

InChI=1S/C9H8N2O4/c1-9(2)10(14)7-5(12)3-4-6(13)8(7)11(9)15/h3-4H,1-2H3