1-[5-phenyl-3-(trifluoromethyl)pyrazol-1-yl]ethanone

Systemtic Name: 1-[5-phenyl-3-(trifluoromethyl)pyrazol-1-yl]ethanone Openeye Name: 1-[5-phenyl-3-(trifluoromethyl)pyrazol-1-yl]ethanone CAS Name: 1-[5-phenyl-3-(trifluoromethyl)-1-pyrazolyl]ethanone IUPAC Name: 1-[5-phenyl-3-(trifluoromethyl)pyrazol-1-yl]ethanone Traditional Name: 1-[5-phenyl-3-(trifluoromethyl)pyrazol-1-yl]ethanone Formula: C12H9F3N2O MolecularWeight: 254.20787

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(=CC(=N1)C(F)(F)F)C2=CC=CC=C2

Isomeric SMILES

CC(=O)N1C(=CC(=N1)C(F)(F)F)C2=CC=CC=C2

InChI

InChI=1S/C12H9F3N2O/c1-8(18)17-10(9-5-3-2-4-6-9)7-11(16-17)12(13,14)15/h2-7H,1H3