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

Systemtic Name: 2-methyl-1-[(5S)-5-oxidanyl-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]propan-1-one Openeye Name: 1-[(5S)-5-hydroxy-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-methyl-propan-1-one CAS Name: 1-[(5S)-5-hydroxy-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-methyl-1-propanone IUPAC Name: 1-[(5S)-5-hydroxy-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-methylpropan-1-one Traditional Name: 1-[(5S)-3-amyl-5-hydroxy-5-(trifluoromethyl)-2-pyrazolin-1-yl]-2-methyl-propan-1-one Formula: C13H21F3N2O2 MolecularWeight: 294.31325

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN(C(C1)(C(F)(F)F)O)C(=O)C(C)C

Isomeric SMILES

CCCCCC1=NN([C@](C1)(C(F)(F)F)O)C(=O)C(C)C

InChI

InChI=1S/C13H21F3N2O2/c1-4-5-6-7-10-8-12(20,13(14,15)16)18(17-10)11(19)9(2)3/h9,20H,4-8H2,1-3H3/t12-/m0/s1