2-methylpropyl 3-oxidanylidene-4-propylsulfanyl-butanoate

Systemtic Name: 2-methylpropyl 3-oxidanylidene-4-propylsulfanyl-butanoate Openeye Name: isobutyl 3-oxo-4-propylsulfanyl-butanoate CAS Name: 3-oxo-4-(propylthio)butanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-oxo-4-propylsulfanylbutanoate Traditional Name: 3-keto-4-(propylthio)butyric acid isobutyl ester Formula: C11H20O3S MolecularWeight: 232.3397

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Descriptors Computed from Structure

Canonical SMILES:

CCCSCC(=O)CC(=O)OCC(C)C

Isomeric SMILES

CCCSCC(=O)CC(=O)OCC(C)C

InChI

InChI=1S/C11H20O3S/c1-4-5-15-8-10(12)6-11(13)14-7-9(2)3/h9H,4-8H2,1-3H3