7-[(4-methylphenyl)carbamoyl]-N4,N6-bis(oxidanyl)-1-oxidanylidene-2,3-dihydrobenzimidazol-1-ium-4,6-diamine oxide

Systemtic Name: 7-[(4-methylphenyl)carbamoyl]-N4,N6-bis(oxidanyl)-1-oxidanylidene-2,3-dihydrobenzimidazol-1-ium-4,6-diamine oxide Openeye Name: N4,N6-dihydroxy-1-oxo-7-(p-tolylcarbamoyl)-2,3-dihydrobenzimidazol-1-ium-4,6-diamine oxide CAS Name: N4,N6-dihydroxy-7-[(4-methylanilino)-oxomethyl]-1-oxo-2,3-dihydrobenzimidazol-1-ium-4,6-diamine oxide IUPAC Name: 4-N,6-N-dihydroxy-7-[(4-methylphenyl)carbamoyl]-1-oxo-2,3-dihydrobenzimidazol-1-ium-4,6-diamine oxide Traditional Name: N,N'-dihydroxy-1-keto-7-(p-tolylcarbamoyl)-2,3-dihydrobenzimidazol-1-ium-4,6-diamine oxide Formula: C15H16N5O6+ MolecularWeight: 362.31744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C3C(=C(C=C2[NH+](O)[O-])[NH+](O)[O-])NC[N+]3=O

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C3C(=C(C=C2[NH+](O)[O-])[NH+](O)[O-])NC[N+]3=O

InChI

InChI=1S/C15H15N5O6/c1-8-2-4-9(5-3-8)17-15(21)12-10(19(23)24)6-11(20(25)26)13-14(12)18(22)7-16-13/h2-6,19-20,23,25H,7H2,1H3,(H-,16,17,21,22)/p+1