2-[2,3-bis(chloranyl)-4-methoxy-phenyl]ethanethioic S-acid

Systemtic Name: 2-[2,3-bis(chloranyl)-4-methoxy-phenyl]ethanethioic S-acid Openeye Name: 2-(2,3-dichloro-4-methoxy-phenyl)ethanethioic S-acid CAS Name: 2-(2,3-dichloro-4-methoxyphenyl)ethanethioic S-acid IUPAC Name: 2-(2,3-dichloro-4-methoxyphenyl)ethanethioic S-acid Traditional Name: 2-(2,3-dichloro-4-methoxy-phenyl)thioacetic acid Formula: C9H8Cl2O2S MolecularWeight: 251.12962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CC(=O)S)Cl)Cl

Isomeric SMILES

COC1=C(C(=C(C=C1)CC(=O)S)Cl)Cl

InChI

InChI=1S/C9H8Cl2O2S/c1-13-6-3-2-5(4-7(12)14)8(10)9(6)11/h2-3H,4H2,1H3,(H,12,14)