3-methyl-1-oxidanidyl-1,2,4-benzotriazin-4-ium 4-oxide

Systemtic Name: 3-methyl-1-oxidanidyl-1,2,4-benzotriazin-4-ium 4-oxide Openeye Name: 3-methyl-1-oxido-1,2,4-benzotriazin-4-ium 4-oxide CAS Name: 3-methyl-1-oxido-1,2,4-benzotriazin-4-ium 4-oxide IUPAC Name: 3-methyl-1-oxido-1,2,4-benzotriazin-4-ium 4-oxide Traditional Name: 3-methyl-1-oxido-1,2,4-benzotriazin-4-ium 4-oxide Formula: C8H7N3O2 MolecularWeight: 177.16008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=CC=CC=C2[N+]1=O)[O-]

Isomeric SMILES

CC1=NN(C2=CC=CC=C2[N+]1=O)[O-]

InChI

InChI=1S/C8H7N3O2/c1-6-9-11(13)8-5-3-2-4-7(8)10(6)12/h2-5H,1H3