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

Systemtic Name: 2-(3-bromanylphenoxy)-1-[(5S)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone Openeye Name: 2-(3-bromophenoxy)-1-[(5S)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone CAS Name: 2-(3-bromophenoxy)-1-[(5S)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone IUPAC Name: 2-(3-bromophenoxy)-1-[(5S)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone Traditional Name: 2-(3-bromophenoxy)-1-[(5S)-5-hydroxy-5-(trifluoromethyl)-2-pyrazolin-1-yl]ethanone Formula: C12H10BrF3N2O3 MolecularWeight: 367.11861

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Descriptors Computed from Structure

Canonical SMILES:

C1C=NN(C1(C(F)(F)F)O)C(=O)COC2=CC(=CC=C2)Br

Isomeric SMILES

C1C=NN([C@]1(C(F)(F)F)O)C(=O)COC2=CC(=CC=C2)Br

InChI

InChI=1S/C12H10BrF3N2O3/c13-8-2-1-3-9(6-8)21-7-10(19)18-11(20,4-5-17-18)12(14,15)16/h1-3,5-6,20H,4,7H2/t11-/m0/s1