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

Systemtic Name: (2-bromophenyl)-[(5S)-5-oxidanyl-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Openeye Name: (2-bromophenyl)-[(5S)-5-hydroxy-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone CAS Name: (2-bromophenyl)-[(5S)-5-hydroxy-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone IUPAC Name: (2-bromophenyl)-[(5S)-5-hydroxy-3-pentyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Traditional Name: [(5S)-3-amyl-5-hydroxy-5-(trifluoromethyl)-2-pyrazolin-1-yl]-(2-bromophenyl)methanone Formula: C16H18BrF3N2O2 MolecularWeight: 407.22553

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CC=CC=C2Br

Isomeric SMILES

CCCCCC1=NN([C@](C1)(C(F)(F)F)O)C(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C16H18BrF3N2O2/c1-2-3-4-7-11-10-15(24,16(18,19)20)22(21-11)14(23)12-8-5-6-9-13(12)17/h5-6,8-9,24H,2-4,7,10H2,1H3/t15-/m0/s1