1-[(3R)-5-butyl-3-oxidanyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]-2-(2-methylphenoxy)ethanone

Systemtic Name: 1-[(3R)-5-butyl-3-oxidanyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]-2-(2-methylphenoxy)ethanone Openeye Name: 1-[(3R)-5-butyl-3-hydroxy-3-(trifluoromethyl)-1H-pyrazol-2-yl]-2-(2-methylphenoxy)ethanone CAS Name: 1-[(3R)-5-butyl-3-hydroxy-3-(trifluoromethyl)-1H-pyrazol-2-yl]-2-(2-methylphenoxy)ethanone IUPAC Name: 1-[(3R)-5-butyl-3-hydroxy-3-(trifluoromethyl)-1H-pyrazol-2-yl]-2-(2-methylphenoxy)ethanone Traditional Name: 1-[(5R)-3-butyl-5-hydroxy-5-(trifluoromethyl)-3-pyrazolin-1-yl]-2-(2-methylphenoxy)ethanone Formula: C17H21F3N2O3 MolecularWeight: 358.35545

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(N(N1)C(=O)COC2=CC=CC=C2C)(C(F)(F)F)O

Isomeric SMILES

CCCCC1=C[C@](N(N1)C(=O)COC2=CC=CC=C2C)(C(F)(F)F)O

InChI

InChI=1S/C17H21F3N2O3/c1-3-4-8-13-10-16(24,17(18,19)20)22(21-13)15(23)11-25-14-9-6-5-7-12(14)2/h5-7,9-10,21,24H,3-4,8,11H2,1-2H3/t16-/m1/s1