4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one CAS Name: 4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one IUPAC Name: 4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-one Formula: C9H6F3N3O MolecularWeight: 229.15865

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C=NNC2=O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)N2C=NNC2=O)C(F)(F)F

InChI

InChI=1S/C9H6F3N3O/c10-9(11,12)6-2-1-3-7(4-6)15-5-13-14-8(15)16/h1-5H,(H,14,16)