1-(1-oxidanidyl-4-oxidanylidene-1,2,4-benzotriazin-4-ium-3-yl)ethane-1,2-diol

Systemtic Name: 1-(1-oxidanidyl-4-oxidanylidene-1,2,4-benzotriazin-4-ium-3-yl)ethane-1,2-diol Openeye Name: 1-(1-oxido-4-oxo-1,2,4-benzotriazin-4-ium-3-yl)ethane-1,2-diol CAS Name: 1-(1-oxido-4-oxo-1,2,4-benzotriazin-4-ium-3-yl)ethane-1,2-diol IUPAC Name: 1-(1-oxido-4-oxo-1,2,4-benzotriazin-4-ium-3-yl)ethane-1,2-diol Traditional Name: 1-(4-keto-1-oxido-1,2,4-benzotriazin-4-ium-3-yl)ethane-1,2-diol Formula: C9H9N3O4 MolecularWeight: 223.18546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(N=C([N+]2=O)C(CO)O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N(N=C([N+]2=O)C(CO)O)[O-]

InChI

InChI=1S/C9H9N3O4/c13-5-8(14)9-10-12(16)7-4-2-1-3-6(7)11(9)15/h1-4,8,13-14H,5H2