1-[5-(4-fluorophenyl)-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]propan-1-one

Systemtic Name: 1-[5-(4-fluorophenyl)-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]propan-1-one Openeye Name: 1-[5-(4-fluorophenyl)-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]propan-1-one CAS Name: 1-[5-(4-fluorophenyl)-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-1-propanone IUPAC Name: 1-[5-(4-fluorophenyl)-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]propan-1-one Traditional Name: 1-[5-(4-fluorophenyl)-5-hydroxy-3-(trifluoromethyl)-2-pyrazolin-1-yl]propan-1-one Formula: C13H12F4N2O2 MolecularWeight: 304.240193

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12F4N2O2/c1-2-11(20)19-12(21,7-10(18-19)13(15,16)17)8-3-5-9(14)6-4-8/h3-6,21H,2,7H2,1H3