3-[3-(4-chloranylphenoxy)propylsulfanyl]propanoic acid

Systemtic Name: 3-[3-(4-chloranylphenoxy)propylsulfanyl]propanoic acid Openeye Name: 3-[3-(4-chlorophenoxy)propylsulfanyl]propanoic acid CAS Name: 3-[3-(4-chlorophenoxy)propylthio]propanoic acid IUPAC Name: 3-[3-(4-chlorophenoxy)propylsulfanyl]propanoic acid Traditional Name: 3-[3-(4-chlorophenoxy)propylthio]propionic acid Formula: C12H15ClO3S MolecularWeight: 274.7637

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCSCCC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1OCCCSCCC(=O)O)Cl

InChI

InChI=1S/C12H15ClO3S/c13-10-2-4-11(5-3-10)16-7-1-8-17-9-6-12(14)15/h2-5H,1,6-9H2,(H,14,15)