3-[(5-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]propanoic acid

Systemtic Name: 3-[(5-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]propanoic acid Openeye Name: 3-[(5-bromo-2-fluoro-phenyl)methylsulfanyl]propanoic acid CAS Name: 3-[(5-bromo-2-fluorophenyl)methylthio]propanoic acid IUPAC Name: 3-[(5-bromo-2-fluorophenyl)methylsulfanyl]propanoic acid Traditional Name: 3-[(5-bromo-2-fluoro-benzyl)thio]propionic acid Formula: C10H10BrFO2S MolecularWeight: 293.152603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)CSCCC(=O)O)F

Isomeric SMILES

C1=CC(=C(C=C1Br)CSCCC(=O)O)F

InChI

InChI=1S/C10H10BrFO2S/c11-8-1-2-9(12)7(5-8)6-15-4-3-10(13)14/h1-2,5H,3-4,6H2,(H,13,14)