3-[5-bromanyl-4,4,5-tris(chloranyl)-3-oxidanylidene-1,2-thiazolidin-2-yl]propanoic acid

Systemtic Name: 3-[5-bromanyl-4,4,5-tris(chloranyl)-3-oxidanylidene-1,2-thiazolidin-2-yl]propanoic acid Openeye Name: 3-(5-bromo-4,4,5-trichloro-3-oxo-isothiazolidin-2-yl)propanoic acid CAS Name: 3-(5-bromo-4,4,5-trichloro-3-oxo-2-isothiazolidinyl)propanoic acid IUPAC Name: 3-(5-bromo-4,4,5-trichloro-3-oxo-1,2-thiazolidin-2-yl)propanoic acid Traditional Name: 3-(5-bromo-4,4,5-trichloro-3-keto-isothiazolidin-2-yl)propionic acid Formula: C6H5BrCl3NO3S MolecularWeight: 357.4368

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Descriptors Computed from Structure

Canonical SMILES:

C(CN1C(=O)C(C(S1)(Cl)Br)(Cl)Cl)C(=O)O

Isomeric SMILES

C(CN1C(=O)C(C(S1)(Cl)Br)(Cl)Cl)C(=O)O

InChI

InChI=1S/C6H5BrCl3NO3S/c7-6(10)5(8,9)4(14)11(15-6)2-1-3(12)13/h1-2H2,(H,12,13)