5-methoxy-2-(sulfanylmethyl)hexanoic acid

Systemtic Name: 5-methoxy-2-(sulfanylmethyl)hexanoic acid Openeye Name: 5-methoxy-2-(sulfanylmethyl)hexanoic acid CAS Name: 2-(mercaptomethyl)-5-methoxyhexanoic acid IUPAC Name: 5-methoxy-2-(sulfanylmethyl)hexanoic acid Traditional Name: 2-(mercaptomethyl)-5-methoxy-hexanoic acid Formula: C8H16O3S MolecularWeight: 192.27584

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(CS)C(=O)O)OC

Isomeric SMILES

CC(CCC(CS)C(=O)O)OC

InChI

InChI=1S/C8H16O3S/c1-6(11-2)3-4-7(5-12)8(9)10/h6-7,12H,3-5H2,1-2H3,(H,9,10)