1-[(3-azanylidene-1-oxidanidyl-4-oxidanyl-1,2,4-benzotriazin-1-ium-7-yl)oxy]butan-2-ol

Systemtic Name: 1-[(3-azanylidene-1-oxidanidyl-4-oxidanyl-1,2,4-benzotriazin-1-ium-7-yl)oxy]butan-2-ol Openeye Name: 1-[(4-hydroxy-3-imino-1-oxido-1,2,4-benzotriazin-1-ium-7-yl)oxy]butan-2-ol CAS Name: 1-[(4-hydroxy-3-imino-1-oxido-1,2,4-benzotriazin-1-ium-7-yl)oxy]-2-butanol IUPAC Name: 1-[(4-hydroxy-3-imino-1-oxido-1,2,4-benzotriazin-1-ium-7-yl)oxy]butan-2-ol Traditional Name: 1-[(4-hydroxy-3-imino-1-oxido-1,2,4-benzotriazin-1-ium-7-yl)oxy]butan-2-ol Formula: C11H14N4O4 MolecularWeight: 266.25326

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC1=CC2=C(C=C1)N(C(=N)N=[N+]2[O-])O)O

Isomeric SMILES

CCC(COC1=CC2=C(C=C1)N(C(=N)N=[N+]2[O-])O)O

InChI

InChI=1S/C11H14N4O4/c1-2-7(16)6-19-8-3-4-9-10(5-8)15(18)13-11(12)14(9)17/h3-5,7,12,16-17H,2,6H2,1H3