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

Systemtic Name: [(3R)-5-butyl-3-oxidanyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]-(4-hydroxyphenyl)methanone Openeye Name: [(3R)-5-butyl-3-hydroxy-3-(trifluoromethyl)-1H-pyrazol-2-yl]-(4-hydroxyphenyl)methanone CAS Name: [(3R)-5-butyl-3-hydroxy-3-(trifluoromethyl)-1H-pyrazol-2-yl]-(4-hydroxyphenyl)methanone IUPAC Name: [(3R)-5-butyl-3-hydroxy-3-(trifluoromethyl)-1H-pyrazol-2-yl]-(4-hydroxyphenyl)methanone Traditional Name: [(5R)-3-butyl-5-hydroxy-5-(trifluoromethyl)-3-pyrazolin-1-yl]-(4-hydroxyphenyl)methanone Formula: C15H17F3N2O3 MolecularWeight: 330.30229

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(N(N1)C(=O)C2=CC=C(C=C2)O)(C(F)(F)F)O

Isomeric SMILES

CCCCC1=C[C@](N(N1)C(=O)C2=CC=C(C=C2)O)(C(F)(F)F)O

InChI

InChI=1S/C15H17F3N2O3/c1-2-3-4-11-9-14(23,15(16,17)18)20(19-11)13(22)10-5-7-12(21)8-6-10/h5-9,19,21,23H,2-4H2,1H3/t14-/m1/s1