methyl 2-methyl-2-[5-(trifluoromethyl)pyridin-2-yl]sulfonyl-propanoate

Systemtic Name: methyl 2-methyl-2-[5-(trifluoromethyl)pyridin-2-yl]sulfonyl-propanoate Openeye Name: methyl 2-methyl-2-[[5-(trifluoromethyl)-2-pyridyl]sulfonyl]propanoate CAS Name: 2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylpropanoate Traditional Name: 2-methyl-2-[[5-(trifluoromethyl)-2-pyridyl]sulfonyl]propionic acid methyl ester Formula: C11H12F3NO4S MolecularWeight: 311.27749

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC)S(=O)(=O)C1=NC=C(C=C1)C(F)(F)F

Isomeric SMILES

CC(C)(C(=O)OC)S(=O)(=O)C1=NC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C11H12F3NO4S/c1-10(2,9(16)19-3)20(17,18)8-5-4-7(6-15-8)11(12,13)14/h4-6H,1-3H3