(2S)-2-[[4-(trifluoromethyloxy)phenyl]methylsulfanyl]propanoate

Systemtic Name: (2S)-2-[[4-(trifluoromethyloxy)phenyl]methylsulfanyl]propanoate Openeye Name: (2S)-2-[[4-(trifluoromethoxy)phenyl]methylsulfanyl]propanoate CAS Name: (2S)-2-[[4-(trifluoromethoxy)phenyl]methylthio]propanoate IUPAC Name: (2S)-2-[[4-(trifluoromethoxy)phenyl]methylsulfanyl]propanoate Traditional Name: (2S)-2-[[4-(trifluoromethoxy)benzyl]thio]propionate Formula: C11H10F3O3S- MolecularWeight: 279.25551

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])SCC1=CC=C(C=C1)OC(F)(F)F

Isomeric SMILES

C[C@@H](C(=O)[O-])SCC1=CC=C(C=C1)OC(F)(F)F

InChI

InChI=1S/C11H11F3O3S/c1-7(10(15)16)18-6-8-2-4-9(5-3-8)17-11(12,13)14/h2-5,7H,6H2,1H3,(H,15,16)/p-1/t7-/m0/s1