1-[(5S)-3-butyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-chloranyl-3-methyl-phenoxy)ethanone

Systemtic Name: 1-[(5S)-3-butyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-chloranyl-3-methyl-phenoxy)ethanone Openeye Name: 1-[(5S)-3-butyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-chloro-3-methyl-phenoxy)ethanone CAS Name: 1-[(5S)-3-butyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-chloro-3-methylphenoxy)ethanone IUPAC Name: 1-[(5S)-3-butyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-chloro-3-methylphenoxy)ethanone Traditional Name: 1-[(5S)-3-butyl-5-hydroxy-5-(trifluoromethyl)-2-pyrazolin-1-yl]-2-(4-chloro-3-methyl-phenoxy)ethanone Formula: C17H20ClF3N2O3 MolecularWeight: 392.80051

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN(C(C1)(C(F)(F)F)O)C(=O)COC2=CC(=C(C=C2)Cl)C

Isomeric SMILES

CCCCC1=NN([C@](C1)(C(F)(F)F)O)C(=O)COC2=CC(=C(C=C2)Cl)C

InChI

InChI=1S/C17H20ClF3N2O3/c1-3-4-5-12-9-16(25,17(19,20)21)23(22-12)15(24)10-26-13-6-7-14(18)11(2)8-13/h6-8,25H,3-5,9-10H2,1-2H3/t16-/m0/s1