methyl (5S)-3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazole-1-carboxylate

Systemtic Name: methyl (5S)-3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazole-1-carboxylate Openeye Name: methyl (5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazole-1-carboxylate CAS Name: (5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazole-1-carboxylic acid methyl ester IUPAC Name: methyl (5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazole-1-carboxylate Traditional Name: (5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-2-pyrazoline-1-carboxylic acid methyl ester Formula: C7H9F3N2O3 MolecularWeight: 226.15317

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H9F3N2O3/c1-4-3-6(14,7(8,9)10)12(11-4)5(13)15-2/h14H,3H2,1-2H3/t6-/m0/s1