3-methylsulfanyl-2-[[4-(trifluoromethyloxy)phenyl]sulfonylamino]propanoic acid

Systemtic Name: 3-methylsulfanyl-2-[[4-(trifluoromethyloxy)phenyl]sulfonylamino]propanoic acid Openeye Name: 3-methylsulfanyl-2-[[4-(trifluoromethoxy)phenyl]sulfonylamino]propanoic acid CAS Name: 3-(methylthio)-2-[[4-(trifluoromethoxy)phenyl]sulfonylamino]propanoic acid IUPAC Name: 3-methylsulfanyl-2-[[4-(trifluoromethoxy)phenyl]sulfonylamino]propanoic acid Traditional Name: 3-(methylthio)-2-[[4-(trifluoromethoxy)phenyl]sulfonylamino]propionic acid Formula: C11H12F3NO5S2 MolecularWeight: 359.34189

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)OC(F)(F)F

Isomeric SMILES

CSCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)OC(F)(F)F

InChI

InChI=1S/C11H12F3NO5S2/c1-21-6-9(10(16)17)15-22(18,19)8-4-2-7(3-5-8)20-11(12,13)14/h2-5,9,15H,6H2,1H3,(H,16,17)