2-methyl-5-(trifluoromethyl)-4H-pyrazol-3-one

Systemtic Name: 2-methyl-5-(trifluoromethyl)-4H-pyrazol-3-one Openeye Name: 2-methyl-5-(trifluoromethyl)-4H-pyrazol-3-one CAS Name: 2-methyl-5-(trifluoromethyl)-4H-pyrazol-3-one IUPAC Name: 2-methyl-5-(trifluoromethyl)-4H-pyrazol-3-one Traditional Name: 2-methyl-5-(trifluoromethyl)-2-pyrazolin-3-one Formula: C5H5F3N2O MolecularWeight: 166.10121

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H5F3N2O/c1-10-4(11)2-3(9-10)5(6,7)8/h2H2,1H3