(4-methylphenyl)-[(5S)-5-oxidanyl-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone

Systemtic Name: (4-methylphenyl)-[(5S)-5-oxidanyl-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Openeye Name: [(5S)-5-hydroxy-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(p-tolyl)methanone CAS Name: [(5S)-5-hydroxy-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-methylphenyl)methanone IUPAC Name: [(5S)-5-hydroxy-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-methylphenyl)methanone Traditional Name: [(5S)-3-amyl-5-hydroxy-5-(trifluoromethyl)-2-pyrazolin-1-yl]-(p-tolyl)methanone Formula: C17H21F3N2O2 MolecularWeight: 342.35605

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCC1=NN([C@](C1)(C(F)(F)F)O)C(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C17H21F3N2O2/c1-3-4-5-6-14-11-16(24,17(18,19)20)22(21-14)15(23)13-9-7-12(2)8-10-13/h7-10,24H,3-6,11H2,1-2H3/t16-/m0/s1