2-(4-methylphenyl)-4-phenyl-1H-1,2,4-triazol-4-ium-5-one

Systemtic Name: 2-(4-methylphenyl)-4-phenyl-1H-1,2,4-triazol-4-ium-5-one Openeye Name: 4-phenyl-2-(p-tolyl)-1H-1,2,4-triazol-4-ium-5-one CAS Name: 2-(4-methylphenyl)-4-phenyl-1H-1,2,4-triazol-4-ium-5-one IUPAC Name: 2-(4-methylphenyl)-4-phenyl-1H-1,2,4-triazol-4-ium-5-one Traditional Name: 4-phenyl-2-(p-tolyl)-1H-1,2,4-triazol-4-ium-5-one Formula: C15H14N3O+ MolecularWeight: 252.29116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=[N+](C(=O)N2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2C=[N+](C(=O)N2)C3=CC=CC=C3

InChI

InChI=1S/C15H13N3O/c1-12-7-9-14(10-8-12)18-11-17(15(19)16-18)13-5-3-2-4-6-13/h2-11H,1H3/p+1