3-oxidanylidene-2-sulfanyl-3-[2,2,2-tris(chloranyl)ethoxy]propanoic acid

Systemtic Name: 3-oxidanylidene-2-sulfanyl-3-[2,2,2-tris(chloranyl)ethoxy]propanoic acid Openeye Name: 3-oxo-2-sulfanyl-3-(2,2,2-trichloroethoxy)propanoic acid CAS Name: 2-mercapto-3-oxo-3-(2,2,2-trichloroethoxy)propanoic acid IUPAC Name: 3-oxo-2-sulfanyl-3-(2,2,2-trichloroethoxy)propanoic acid Traditional Name: 3-keto-2-mercapto-3-(2,2,2-trichloroethoxy)propionic acid Formula: C5H5Cl3O4S MolecularWeight: 267.5148

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Descriptors Computed from Structure

Canonical SMILES:

C(C(Cl)(Cl)Cl)OC(=O)C(C(=O)O)S

Isomeric SMILES

C(C(Cl)(Cl)Cl)OC(=O)C(C(=O)O)S

InChI

InChI=1S/C5H5Cl3O4S/c6-5(7,8)1-12-4(11)2(13)3(9)10/h2,13H,1H2,(H,9,10)