2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]propanoic acid

Systemtic Name: 2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]propanoic acid Openeye Name: 2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]propanoic acid CAS Name: 2-[(3-fluoro-4-methoxyphenyl)methylthio]propanoic acid IUPAC Name: 2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]propanoic acid Traditional Name: 2-[(3-fluoro-4-methoxy-benzyl)thio]propionic acid Formula: C11H13FO3S MolecularWeight: 244.282523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC1=CC(=C(C=C1)OC)F

Isomeric SMILES

CC(C(=O)O)SCC1=CC(=C(C=C1)OC)F

InChI

InChI=1S/C11H13FO3S/c1-7(11(13)14)16-6-8-3-4-10(15-2)9(12)5-8/h3-5,7H,6H2,1-2H3,(H,13,14)