2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylethyl 2-methylpropanoate

Systemtic Name: 2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylethyl 2-methylpropanoate Openeye Name: 2-[[5-(trifluoromethyl)-2-pyridyl]sulfonyl]ethyl 2-methylpropanoate CAS Name: 2-methylpropanoic acid 2-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]ethyl ester IUPAC Name: 2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylethyl 2-methylpropanoate Traditional Name: 2-methylpropionic acid 2-[[5-(trifluoromethyl)-2-pyridyl]sulfonyl]ethyl ester Formula: C12H14F3NO4S MolecularWeight: 325.30407

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OCCS(=O)(=O)C1=NC=C(C=C1)C(F)(F)F

Isomeric SMILES

CC(C)C(=O)OCCS(=O)(=O)C1=NC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C12H14F3NO4S/c1-8(2)11(17)20-5-6-21(18,19)10-4-3-9(7-16-10)12(13,14)15/h3-4,7-8H,5-6H2,1-2H3