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

Systemtic Name: 2-[(2-bromanyl-5-fluoranyl-phenyl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(2-bromo-5-fluoro-phenyl)methylsulfanyl]acetic acid CAS Name: 2-[(2-bromo-5-fluorophenyl)methylthio]acetic acid IUPAC Name: 2-[(2-bromo-5-fluorophenyl)methylsulfanyl]acetic acid Traditional Name: 2-[(2-bromo-5-fluoro-benzyl)thio]acetic acid Formula: C9H8BrFO2S MolecularWeight: 279.126023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)CSCC(=O)O)Br

Isomeric SMILES

C1=CC(=C(C=C1F)CSCC(=O)O)Br

InChI

InChI=1S/C9H8BrFO2S/c10-8-2-1-7(11)3-6(8)4-14-5-9(12)13/h1-3H,4-5H2,(H,12,13)