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

Systemtic Name: 2-methyl-5-[3-(trifluoromethyl)phenyl]-4H-pyrazol-3-one Openeye Name: 2-methyl-5-[3-(trifluoromethyl)phenyl]-4H-pyrazol-3-one CAS Name: 2-methyl-5-[3-(trifluoromethyl)phenyl]-4H-pyrazol-3-one IUPAC Name: 2-methyl-5-[3-(trifluoromethyl)phenyl]-4H-pyrazol-3-one Traditional Name: 2-methyl-5-[3-(trifluoromethyl)phenyl]-2-pyrazolin-3-one Formula: C11H9F3N2O MolecularWeight: 242.19717

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CC(=N1)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CN1C(=O)CC(=N1)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C11H9F3N2O/c1-16-10(17)6-9(15-16)7-3-2-4-8(5-7)11(12,13)14/h2-5H,6H2,1H3