2-[2,4,5-tris(chloranyl)phenyl]ethanethioic S-acid

Systemtic Name: 2-[2,4,5-tris(chloranyl)phenyl]ethanethioic S-acid Openeye Name: 2-(2,4,5-trichlorophenyl)ethanethioic S-acid CAS Name: 2-(2,4,5-trichlorophenyl)ethanethioic S-acid IUPAC Name: 2-(2,4,5-trichlorophenyl)ethanethioic S-acid Traditional Name: 2-(2,4,5-trichlorophenyl)thioacetic acid Formula: C8H5Cl3OS MolecularWeight: 255.5487

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1Cl)Cl)Cl)CC(=O)S

Isomeric SMILES

C1=C(C(=CC(=C1Cl)Cl)Cl)CC(=O)S

InChI

InChI=1S/C8H5Cl3OS/c9-5-3-7(11)6(10)1-4(5)2-8(12)13/h1,3H,2H2,(H,12,13)