(2S)-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoate

Systemtic Name: (2S)-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoate Openeye Name: (2S)-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoate CAS Name: (2S)-2-[5-methyl-3-(trifluoromethyl)-1-pyrazolyl]propanoate IUPAC Name: (2S)-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoate Traditional Name: (2S)-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propionate Formula: C8H8F3N2O2- MolecularWeight: 221.15653

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(C)C(=O)[O-])C(F)(F)F

Isomeric SMILES

CC1=CC(=NN1[C@@H](C)C(=O)[O-])C(F)(F)F

InChI

InChI=1S/C8H9F3N2O2/c1-4-3-6(8(9,10)11)12-13(4)5(2)7(14)15/h3,5H,1-2H3,(H,14,15)/p-1/t5-/m0/s1