3-[2,6-bis(chloranyl)phenyl]sulfanylpropanoic acid

Systemtic Name: 3-[2,6-bis(chloranyl)phenyl]sulfanylpropanoic acid Openeye Name: 3-(2,6-dichlorophenyl)sulfanylpropanoic acid CAS Name: 3-[(2,6-dichlorophenyl)thio]propanoic acid IUPAC Name: 3-(2,6-dichlorophenyl)sulfanylpropanoic acid Traditional Name: 3-[(2,6-dichlorophenyl)thio]propionic acid Formula: C9H8Cl2O2S MolecularWeight: 251.12962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)SCCC(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)SCCC(=O)O)Cl

InChI

InChI=1S/C9H8Cl2O2S/c10-6-2-1-3-7(11)9(6)14-5-4-8(12)13/h1-3H,4-5H2,(H,12,13)