4-methyl-1-phenyl-1,2,4-triazol-4-ium-3-olate

Systemtic Name: 4-methyl-1-phenyl-1,2,4-triazol-4-ium-3-olate Openeye Name: 4-methyl-1-phenyl-1,2,4-triazol-4-ium-3-olate CAS Name: 4-methyl-1-phenyl-1,2,4-triazol-4-ium-3-olate IUPAC Name: 4-methyl-1-phenyl-1,2,4-triazol-4-ium-3-olate Traditional Name: 4-methyl-1-phenyl-1,2,4-triazol-4-ium-3-olate Formula: C9H9N3O MolecularWeight: 175.18726

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(N=C1[O-])C2=CC=CC=C2

Isomeric SMILES

C[N+]1=CN(N=C1[O-])C2=CC=CC=C2

InChI

InChI=1S/C9H9N3O/c1-11-7-12(10-9(11)13)8-5-3-2-4-6-8/h2-7H,1H3