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

Systemtic Name: [(5S)-5-oxidanyl-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-pyridin-4-yl-methanone Openeye Name: [(5S)-5-hydroxy-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyridyl)methanone CAS Name: [(5S)-5-hydroxy-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-pyridin-4-ylmethanone IUPAC Name: [(5S)-5-hydroxy-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-pyridin-4-ylmethanone Traditional Name: [(5S)-3-amyl-5-hydroxy-5-(trifluoromethyl)-2-pyrazolin-1-yl]-(4-pyridyl)methanone Formula: C15H18F3N3O2 MolecularWeight: 329.31753

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18F3N3O2/c1-2-3-4-5-12-10-14(23,15(16,17)18)21(20-12)13(22)11-6-8-19-9-7-11/h6-9,23H,2-5,10H2,1H3/t14-/m0/s1