3-ethanoylsulfanylpropyl 3-oxidanylidenebutanoate

Systemtic Name: 3-ethanoylsulfanylpropyl 3-oxidanylidenebutanoate Openeye Name: 3-acetylsulfanylpropyl 3-oxobutanoate CAS Name: 3-oxobutanoic acid 3-(acetylthio)propyl ester IUPAC Name: 3-acetylsulfanylpropyl 3-oxobutanoate Traditional Name: 3-ketobutyric acid 3-(acetylthio)propyl ester Formula: C9H14O4S MolecularWeight: 218.27006

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OCCCSC(=O)C

Isomeric SMILES

CC(=O)CC(=O)OCCCSC(=O)C

InChI

InChI=1S/C9H14O4S/c1-7(10)6-9(12)13-4-3-5-14-8(2)11/h3-6H2,1-2H3