6-(1-benzofuran-2-yloxy)-2-sulfanyl-hexanoic acid

Systemtic Name: 6-(1-benzofuran-2-yloxy)-2-sulfanyl-hexanoic acid Openeye Name: 6-(benzofuran-2-yloxy)-2-sulfanyl-hexanoic acid CAS Name: 6-(2-benzofuranyloxy)-2-mercaptohexanoic acid IUPAC Name: 6-(1-benzofuran-2-yloxy)-2-sulfanylhexanoic acid Traditional Name: 6-(benzofuran-2-yloxy)-2-mercapto-hexanoic acid Formula: C14H16O4S MolecularWeight: 280.33944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)OCCCCC(C(=O)O)S

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)OCCCCC(C(=O)O)S

InChI

InChI=1S/C14H16O4S/c15-14(16)12(19)7-3-4-8-17-13-9-10-5-1-2-6-11(10)18-13/h1-2,5-6,9,12,19H,3-4,7-8H2,(H,15,16)