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

Systemtic Name: 2-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]propanoic acid Openeye Name: 2-[(4-bromo-2-fluoro-phenyl)methylsulfanyl]propanoic acid CAS Name: 2-[(4-bromo-2-fluorophenyl)methylthio]propanoic acid IUPAC Name: 2-[(4-bromo-2-fluorophenyl)methylsulfanyl]propanoic acid Traditional Name: 2-[(4-bromo-2-fluoro-benzyl)thio]propionic acid Formula: C10H10BrFO2S MolecularWeight: 293.152603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10BrFO2S/c1-6(10(13)14)15-5-7-2-3-8(11)4-9(7)12/h2-4,6H,5H2,1H3,(H,13,14)