1-oxidanidyl-4-oxidanyl-N-(phenylmethyl)-1,2,4-benzotriazin-1-ium-3-imine

Systemtic Name: 1-oxidanidyl-4-oxidanyl-N-(phenylmethyl)-1,2,4-benzotriazin-1-ium-3-imine Openeye Name: N-benzyl-4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-imine CAS Name: 4-hydroxy-1-oxido-N-(phenylmethyl)-1,2,4-benzotriazin-1-ium-3-imine IUPAC Name: N-benzyl-4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-imine Traditional Name: benzyl-(4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-ylidene)amine Formula: C14H12N4O2 MolecularWeight: 268.27068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN=C2N=[N+](C3=CC=CC=C3N2O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN=C2N=[N+](C3=CC=CC=C3N2O)[O-]

InChI

InChI=1S/C14H12N4O2/c19-17-12-8-4-5-9-13(12)18(20)16-14(17)15-10-11-6-2-1-3-7-11/h1-9,19H,10H2