2-(ethanoylsulfanylmethyl)-3-(2-fluorophenyl)butanoic acid

Systemtic Name: 2-(ethanoylsulfanylmethyl)-3-(2-fluorophenyl)butanoic acid Openeye Name: 2-(acetylsulfanylmethyl)-3-(2-fluorophenyl)butanoic acid CAS Name: 2-[(acetylthio)methyl]-3-(2-fluorophenyl)butanoic acid IUPAC Name: 2-(acetylsulfanylmethyl)-3-(2-fluorophenyl)butanoic acid Traditional Name: 2-[(acetylthio)methyl]-3-(2-fluorophenyl)butyric acid Formula: C13H15FO3S MolecularWeight: 270.319803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1F)C(CSC(=O)C)C(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1F)C(CSC(=O)C)C(=O)O

InChI

InChI=1S/C13H15FO3S/c1-8(10-5-3-4-6-12(10)14)11(13(16)17)7-18-9(2)15/h3-6,8,11H,7H2,1-2H3,(H,16,17)