(2S)-2-(4-fluoranyl-3-methyl-phenyl)sulfanylpropanoic acid

Systemtic Name: (2S)-2-(4-fluoranyl-3-methyl-phenyl)sulfanylpropanoic acid Openeye Name: (2S)-2-(4-fluoro-3-methyl-phenyl)sulfanylpropanoic acid CAS Name: (2S)-2-[(4-fluoro-3-methylphenyl)thio]propanoic acid IUPAC Name: (2S)-2-(4-fluoro-3-methylphenyl)sulfanylpropanoic acid Traditional Name: (2S)-2-[(4-fluoro-3-methyl-phenyl)thio]propionic acid Formula: C10H11FO2S MolecularWeight: 214.256543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC(C)C(=O)O)F

Isomeric SMILES

CC1=C(C=CC(=C1)S[C@@H](C)C(=O)O)F

InChI

InChI=1S/C10H11FO2S/c1-6-5-8(3-4-9(6)11)14-7(2)10(12)13/h3-5,7H,1-2H3,(H,12,13)/t7-/m0/s1