methyl 2-acetamido-4-(trifluoromethylsulfanyl)butanoate

Systemtic Name: methyl 2-acetamido-4-(trifluoromethylsulfanyl)butanoate Openeye Name: methyl 2-acetamido-4-(trifluoromethylsulfanyl)butanoate CAS Name: 2-acetamido-4-(trifluoromethylthio)butanoic acid methyl ester IUPAC Name: methyl 2-acetamido-4-(trifluoromethylsulfanyl)butanoate Traditional Name: 2-acetamido-4-(trifluoromethylthio)butyric acid methyl ester Formula: C8H12F3NO3S MolecularWeight: 259.24599

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCSC(F)(F)F)C(=O)OC

Isomeric SMILES

CC(=O)NC(CCSC(F)(F)F)C(=O)OC

InChI

InChI=1S/C8H12F3NO3S/c1-5(13)12-6(7(14)15-2)3-4-16-8(9,10)11/h6H,3-4H2,1-2H3,(H,12,13)