2-methyl-5-(trifluoromethyl)-1H-1,2,4-triazol-3-one

Systemtic Name: 2-methyl-5-(trifluoromethyl)-1H-1,2,4-triazol-3-one Openeye Name: 2-methyl-5-(trifluoromethyl)-1H-1,2,4-triazol-3-one CAS Name: 2-methyl-5-(trifluoromethyl)-1H-1,2,4-triazol-3-one IUPAC Name: 2-methyl-5-(trifluoromethyl)-1H-1,2,4-triazol-3-one Traditional Name: 2-methyl-5-(trifluoromethyl)-1H-1,2,4-triazol-3-one Formula: C4H4F3N3O MolecularWeight: 167.08927

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N=C(N1)C(F)(F)F

Isomeric SMILES

CN1C(=O)N=C(N1)C(F)(F)F

InChI

InChI=1S/C4H4F3N3O/c1-10-3(11)8-2(9-10)4(5,6)7/h1H3,(H,8,9,11)