furan-2-yl-[3-(3-methylbutyl)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone

Systemtic Name: furan-2-yl-[3-(3-methylbutyl)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Openeye Name: 2-furyl-[5-hydroxy-3-isopentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone CAS Name: 2-furanyl-[5-hydroxy-3-(3-methylbutyl)-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone IUPAC Name: furan-2-yl-[5-hydroxy-3-(3-methylbutyl)-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Traditional Name: 2-furyl-[5-hydroxy-3-isoamyl-5-(trifluoromethyl)-2-pyrazolin-1-yl]methanone Formula: C14H17F3N2O3 MolecularWeight: 318.29159

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CC=CO2

Isomeric SMILES

CC(C)CCC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CC=CO2

InChI

InChI=1S/C14H17F3N2O3/c1-9(2)5-6-10-8-13(21,14(15,16)17)19(18-10)12(20)11-4-3-7-22-11/h3-4,7,9,21H,5-6,8H2,1-2H3