6-(4-chloranylphenoxy)-2-sulfanyl-hexanoic acid

Systemtic Name: 6-(4-chloranylphenoxy)-2-sulfanyl-hexanoic acid Openeye Name: 6-(4-chlorophenoxy)-2-sulfanyl-hexanoic acid CAS Name: 6-(4-chlorophenoxy)-2-mercaptohexanoic acid IUPAC Name: 6-(4-chlorophenoxy)-2-sulfanylhexanoic acid Traditional Name: 6-(4-chlorophenoxy)-2-mercapto-hexanoic acid Formula: C12H15ClO3S MolecularWeight: 274.7637

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCCC(C(=O)O)S)Cl

Isomeric SMILES

C1=CC(=CC=C1OCCCCC(C(=O)O)S)Cl

InChI

InChI=1S/C12H15ClO3S/c13-9-4-6-10(7-5-9)16-8-2-1-3-11(17)12(14)15/h4-7,11,17H,1-3,8H2,(H,14,15)