(3-methylphenyl)-[(5S)-5-oxidanyl-3,5-bis(trifluoromethyl)-4H-pyrazol-1-yl]methanone

Systemtic Name: (3-methylphenyl)-[(5S)-5-oxidanyl-3,5-bis(trifluoromethyl)-4H-pyrazol-1-yl]methanone Openeye Name: [(5S)-5-hydroxy-3,5-bis(trifluoromethyl)-4H-pyrazol-1-yl]-(m-tolyl)methanone CAS Name: [(5S)-5-hydroxy-3,5-bis(trifluoromethyl)-4H-pyrazol-1-yl]-(3-methylphenyl)methanone IUPAC Name: [(5S)-5-hydroxy-3,5-bis(trifluoromethyl)-4H-pyrazol-1-yl]-(3-methylphenyl)methanone Traditional Name: [(5S)-5-hydroxy-3,5-bis(trifluoromethyl)-2-pyrazolin-1-yl]-(m-tolyl)methanone Formula: C13H10F6N2O2 MolecularWeight: 340.221119

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2C(CC(=N2)C(F)(F)F)(C(F)(F)F)O

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2[C@](CC(=N2)C(F)(F)F)(C(F)(F)F)O

InChI

InChI=1S/C13H10F6N2O2/c1-7-3-2-4-8(5-7)10(22)21-11(23,13(17,18)19)6-9(20-21)12(14,15)16/h2-5,23H,6H2,1H3/t11-/m0/s1