2-(4-chloranyl-3-methyl-phenoxy)-1-[(5S)-3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-1-[(5S)-3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone Openeye Name: 2-(4-chloro-3-methyl-phenoxy)-1-[(5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone CAS Name: 2-(4-chloro-3-methylphenoxy)-1-[(5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone IUPAC Name: 2-(4-chloro-3-methylphenoxy)-1-[(5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone Traditional Name: 2-(4-chloro-3-methyl-phenoxy)-1-[(5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-2-pyrazolin-1-yl]ethanone Formula: C14H14ClF3N2O3 MolecularWeight: 350.72077

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C(F)(F)F)O)C(=O)COC2=CC(=C(C=C2)Cl)C

Isomeric SMILES

CC1=NN([C@](C1)(C(F)(F)F)O)C(=O)COC2=CC(=C(C=C2)Cl)C

InChI

InChI=1S/C14H14ClF3N2O3/c1-8-5-10(3-4-11(8)15)23-7-12(21)20-13(22,14(16,17)18)6-9(2)19-20/h3-5,22H,6-7H2,1-2H3/t13-/m0/s1