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

Systemtic Name: (4-methoxyphenyl)-[(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]-(4-methoxyphenyl)methanone CAS Name: [(5S)-5-hydroxy-3,5-bis(trifluoromethyl)-4H-pyrazol-1-yl]-(4-methoxyphenyl)methanone IUPAC Name: [(5S)-5-hydroxy-3,5-bis(trifluoromethyl)-4H-pyrazol-1-yl]-(4-methoxyphenyl)methanone Traditional Name: [(5S)-5-hydroxy-3,5-bis(trifluoromethyl)-2-pyrazolin-1-yl]-(4-methoxyphenyl)methanone Formula: C13H10F6N2O3 MolecularWeight: 356.220519

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2C(CC(=N2)C(F)(F)F)(C(F)(F)F)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2[C@](CC(=N2)C(F)(F)F)(C(F)(F)F)O

InChI

InChI=1S/C13H10F6N2O3/c1-24-8-4-2-7(3-5-8)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