4-butoxy-4-oxidanylidene-3-sulfanyl-butanoic acid

Systemtic Name: 4-butoxy-4-oxidanylidene-3-sulfanyl-butanoic acid Openeye Name: 4-butoxy-4-oxo-3-sulfanyl-butanoic acid CAS Name: 4-butoxy-3-mercapto-4-oxobutanoic acid IUPAC Name: 4-butoxy-4-oxo-3-sulfanylbutanoic acid Traditional Name: 4-butoxy-4-keto-3-mercapto-butyric acid Formula: C8H14O4S MolecularWeight: 206.25936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CC(=O)O)S

Isomeric SMILES

CCCCOC(=O)C(CC(=O)O)S

InChI

InChI=1S/C8H14O4S/c1-2-3-4-12-8(11)6(13)5-7(9)10/h6,13H,2-5H2,1H3,(H,9,10)