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

Systemtic Name: 2-(4-fluorophenyl)-5-(trifluoromethyl)-1H-1,2,4-triazol-3-one Openeye Name: 2-(4-fluorophenyl)-5-(trifluoromethyl)-1H-1,2,4-triazol-3-one CAS Name: 2-(4-fluorophenyl)-5-(trifluoromethyl)-1H-1,2,4-triazol-3-one IUPAC Name: 2-(4-fluorophenyl)-5-(trifluoromethyl)-1H-1,2,4-triazol-3-one Traditional Name: 2-(4-fluorophenyl)-5-(trifluoromethyl)-1H-1,2,4-triazol-3-one Formula: C9H5F4N3O MolecularWeight: 247.149113

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)N=C(N2)C(F)(F)F)F

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)N=C(N2)C(F)(F)F)F

InChI

InChI=1S/C9H5F4N3O/c10-5-1-3-6(4-2-5)16-8(17)14-7(15-16)9(11,12)13/h1-4H,(H,14,15,17)