1-[3-(4-fluorophenyl)-3-oxidanyl-5-(trifluoromethyl)-1H-pyrazol-2-yl]propan-1-one

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(=O)N1C(C=C(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/h3-7,18,21H,2H2,1H3