2-(3-methylphenyl)-1H-1,2,4-triazol-3-one

Systemtic Name: 2-(3-methylphenyl)-1H-1,2,4-triazol-3-one Openeye Name: 2-(m-tolyl)-1H-1,2,4-triazol-3-one CAS Name: 2-(3-methylphenyl)-1H-1,2,4-triazol-3-one IUPAC Name: 2-(3-methylphenyl)-1H-1,2,4-triazol-3-one Traditional Name: 2-(m-tolyl)-1H-1,2,4-triazol-3-one Formula: C9H9N3O MolecularWeight: 175.18726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)N=CN2

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)N=CN2

InChI

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