3-(3-heptoxy-3-oxidanylidene-propyl)sulfanylpropanoic acid

Systemtic Name: 3-(3-heptoxy-3-oxidanylidene-propyl)sulfanylpropanoic acid Openeye Name: 3-(3-heptoxy-3-oxo-propyl)sulfanylpropanoic acid CAS Name: 3-[(3-heptoxy-3-oxopropyl)thio]propanoic acid IUPAC Name: 3-(3-heptoxy-3-oxopropyl)sulfanylpropanoic acid Traditional Name: 3-[(3-heptoxy-3-keto-propyl)thio]propionic acid Formula: C13H24O4S MolecularWeight: 276.39226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)CCSCCC(=O)O

Isomeric SMILES

CCCCCCCOC(=O)CCSCCC(=O)O

InChI

InChI=1S/C13H24O4S/c1-2-3-4-5-6-9-17-13(16)8-11-18-10-7-12(14)15/h2-11H2,1H3,(H,14,15)