4-methylsulfanyl-3-(trifluoromethyl)pent-4-enoic acid

Systemtic Name: 4-methylsulfanyl-3-(trifluoromethyl)pent-4-enoic acid Openeye Name: 4-methylsulfanyl-3-(trifluoromethyl)pent-4-enoic acid CAS Name: 4-(methylthio)-3-(trifluoromethyl)-4-pentenoic acid IUPAC Name: 4-methylsulfanyl-3-(trifluoromethyl)pent-4-enoic acid Traditional Name: 4-(methylthio)-3-(trifluoromethyl)pent-4-enoic acid Formula: C7H9F3O2S MolecularWeight: 214.20537

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=C)C(CC(=O)O)C(F)(F)F

Isomeric SMILES

CSC(=C)C(CC(=O)O)C(F)(F)F

InChI

InChI=1S/C7H9F3O2S/c1-4(13-2)5(3-6(11)12)7(8,9)10/h5H,1,3H2,2H3,(H,11,12)