(4-fluorophenyl)-[(5S)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone

Systemtic Name: (4-fluorophenyl)-[(5S)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Openeye Name: (4-fluorophenyl)-[(5S)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone CAS Name: (4-fluorophenyl)-[(5S)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone IUPAC Name: (4-fluorophenyl)-[(5S)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Traditional Name: (4-fluorophenyl)-[(5S)-5-hydroxy-5-(trifluoromethyl)-2-pyrazolin-1-yl]methanone Formula: C11H8F4N2O2 MolecularWeight: 276.187033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=NN(C1(C(F)(F)F)O)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

C1C=NN([C@]1(C(F)(F)F)O)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C11H8F4N2O2/c12-8-3-1-7(2-4-8)9(18)17-10(19,5-6-16-17)11(13,14)15/h1-4,6,19H,5H2/t10-/m0/s1