(3-methoxy-4-oxidanyl-phenyl)-[(5S)-3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone

Systemtic Name: (3-methoxy-4-oxidanyl-phenyl)-[(5S)-3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Openeye Name: (4-hydroxy-3-methoxy-phenyl)-[(5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone CAS Name: (4-hydroxy-3-methoxyphenyl)-[(5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone IUPAC Name: (4-hydroxy-3-methoxyphenyl)-[(5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Traditional Name: (4-hydroxy-3-methoxy-phenyl)-[(5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-2-pyrazolin-1-yl]methanone Formula: C13H13F3N2O4 MolecularWeight: 318.24853

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CC(=C(C=C2)O)OC

Isomeric SMILES

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

InChI

InChI=1S/C13H13F3N2O4/c1-7-6-12(21,13(14,15)16)18(17-7)11(20)8-3-4-9(19)10(5-8)22-2/h3-5,19,21H,6H2,1-2H3/t12-/m0/s1