3-[2-(3-chloranylphenoxy)ethylsulfanyl]propanoic acid

Systemtic Name: 3-[2-(3-chloranylphenoxy)ethylsulfanyl]propanoic acid Openeye Name: 3-[2-(3-chlorophenoxy)ethylsulfanyl]propanoic acid CAS Name: 3-[2-(3-chlorophenoxy)ethylthio]propanoic acid IUPAC Name: 3-[2-(3-chlorophenoxy)ethylsulfanyl]propanoic acid Traditional Name: 3-[2-(3-chlorophenoxy)ethylthio]propionic acid Formula: C11H13ClO3S MolecularWeight: 260.73712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)OCCSCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)OCCSCCC(=O)O

InChI

InChI=1S/C11H13ClO3S/c12-9-2-1-3-10(8-9)15-5-7-16-6-4-11(13)14/h1-3,8H,4-7H2,(H,13,14)