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

Systemtic Name: 1-[(5R)-5-butyl-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[(5R)-5-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-phenoxy-ethanone CAS Name: 1-[(5R)-5-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-phenoxyethanone IUPAC Name: 1-[(5R)-5-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-phenoxyethanone Traditional Name: 1-[(5R)-5-butyl-5-hydroxy-3-(trifluoromethyl)-2-pyrazolin-1-yl]-2-phenoxy-ethanone Formula: C16H19F3N2O3 MolecularWeight: 344.32887

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CC(=NN1C(=O)COC2=CC=CC=C2)C(F)(F)F)O

Isomeric SMILES

CCCC[C@]1(CC(=NN1C(=O)COC2=CC=CC=C2)C(F)(F)F)O

InChI

InChI=1S/C16H19F3N2O3/c1-2-3-9-15(23)10-13(16(17,18)19)20-21(15)14(22)11-24-12-7-5-4-6-8-12/h4-8,23H,2-3,9-11H2,1H3/t15-/m1/s1