2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]propanoic acid

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]propanoic acid Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]propanoic acid CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]propanoic acid IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]propanoic acid Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]propionic acid Formula: C10H10ClFO2S MolecularWeight: 248.701603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC1=C(C=CC=C1Cl)F

Isomeric SMILES

CC(C(=O)O)SCC1=C(C=CC=C1Cl)F

InChI

InChI=1S/C10H10ClFO2S/c1-6(10(13)14)15-5-7-8(11)3-2-4-9(7)12/h2-4,6H,5H2,1H3,(H,13,14)