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

Systemtic Name: 2-methyl-1-[(5R)-5-oxidanyl-5-pyridin-4-yl-3-(trifluoromethyl)-4H-pyrazol-1-yl]propan-1-one Openeye Name: 1-[(5R)-5-hydroxy-5-(4-pyridyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-methyl-propan-1-one CAS Name: 1-[(5R)-5-hydroxy-5-pyridin-4-yl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-methyl-1-propanone IUPAC Name: 1-[(5R)-5-hydroxy-5-pyridin-4-yl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-methylpropan-1-one Traditional Name: 1-[(5R)-5-hydroxy-5-(4-pyridyl)-3-(trifluoromethyl)-2-pyrazolin-1-yl]-2-methyl-propan-1-one Formula: C13H14F3N3O2 MolecularWeight: 301.26437

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C(=O)N1[C@@](CC(=N1)C(F)(F)F)(C2=CC=NC=C2)O

InChI

InChI=1S/C13H14F3N3O2/c1-8(2)11(20)19-12(21,9-3-5-17-6-4-9)7-10(18-19)13(14,15)16/h3-6,8,21H,7H2,1-2H3/t12-/m1/s1