2-methyl-4-phenyl-1H-1,2,4-triazol-4-ium-5-one

Systemtic Name: 2-methyl-4-phenyl-1H-1,2,4-triazol-4-ium-5-one Openeye Name: 2-methyl-4-phenyl-1H-1,2,4-triazol-4-ium-5-one CAS Name: 2-methyl-4-phenyl-1H-1,2,4-triazol-4-ium-5-one IUPAC Name: 2-methyl-4-phenyl-1H-1,2,4-triazol-4-ium-5-one Traditional Name: 2-methyl-4-phenyl-1H-1,2,4-triazol-4-ium-5-one Formula: C9H10N3O+ MolecularWeight: 176.1952

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=[N+](C(=O)N1)C2=CC=CC=C2

Isomeric SMILES

CN1C=[N+](C(=O)N1)C2=CC=CC=C2

InChI

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