3-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]sulfanylpropanoate

Systemtic Name: 3-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]sulfanylpropanoate Openeye Name: 3-(3,5-dichloro-4-hydroxy-phenyl)sulfanylpropanoate CAS Name: 3-[(3,5-dichloro-4-hydroxyphenyl)thio]propanoate IUPAC Name: 3-(3,5-dichloro-4-hydroxyphenyl)sulfanylpropanoate Traditional Name: 3-[(3,5-dichloro-4-hydroxy-phenyl)thio]propionate Formula: C9H7Cl2O3S- MolecularWeight: 266.12108

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)O)Cl)SCCC(=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1Cl)O)Cl)SCCC(=O)[O-]

InChI

InChI=1S/C9H8Cl2O3S/c10-6-3-5(4-7(11)9(6)14)15-2-1-8(12)13/h3-4,14H,1-2H2,(H,12,13)/p-1