(4-chloranyl-2-oxidanyl-phenyl)-[(5R)-3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone

Systemtic Name: (4-chloranyl-2-oxidanyl-phenyl)-[(5R)-3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Openeye Name: (4-chloro-2-hydroxy-phenyl)-[(5R)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone CAS Name: (4-chloro-2-hydroxyphenyl)-[(5R)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone IUPAC Name: (4-chloro-2-hydroxyphenyl)-[(5R)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Traditional Name: (4-chloro-2-hydroxy-phenyl)-[(5R)-5-hydroxy-3-methyl-5-(trifluoromethyl)-2-pyrazolin-1-yl]methanone Formula: C12H10ClF3N2O3 MolecularWeight: 322.66761

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10ClF3N2O3/c1-6-5-11(21,12(14,15)16)18(17-6)10(20)8-3-2-7(13)4-9(8)19/h2-4,19,21H,5H2,1H3/t11-/m1/s1