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

Systemtic Name: 2-methyl-1-[3-(3-methylbutyl)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]propan-1-one Openeye Name: 1-[5-hydroxy-3-isopentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-methyl-propan-1-one CAS Name: 1-[5-hydroxy-3-(3-methylbutyl)-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-methyl-1-propanone IUPAC Name: 1-[5-hydroxy-3-(3-methylbutyl)-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-methylpropan-1-one Traditional Name: 1-[5-hydroxy-3-isoamyl-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:

CC(C)CCC1=NN(C(C1)(C(F)(F)F)O)C(=O)C(C)C

Isomeric SMILES

CC(C)CCC1=NN(C(C1)(C(F)(F)F)O)C(=O)C(C)C

InChI

InChI=1S/C13H21F3N2O2/c1-8(2)5-6-10-7-12(20,13(14,15)16)18(17-10)11(19)9(3)4/h8-9,20H,5-7H2,1-4H3