3-methylbutyl 4-(3-methylbutylsulfanyl)-2-oxidanyl-4-oxidanylidene-butanoate

Systemtic Name: 3-methylbutyl 4-(3-methylbutylsulfanyl)-2-oxidanyl-4-oxidanylidene-butanoate Openeye Name: isopentyl 2-hydroxy-4-isopentylsulfanyl-4-oxo-butanoate CAS Name: 2-hydroxy-4-(3-methylbutylthio)-4-oxobutanoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-hydroxy-4-(3-methylbutylsulfanyl)-4-oxobutanoate Traditional Name: 2-hydroxy-4-(isoamylthio)-4-keto-butyric acid isoamyl ester Formula: C14H26O4S MolecularWeight: 290.41884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C(CC(=O)SCCC(C)C)O

Isomeric SMILES

CC(C)CCOC(=O)C(CC(=O)SCCC(C)C)O

InChI

InChI=1S/C14H26O4S/c1-10(2)5-7-18-14(17)12(15)9-13(16)19-8-6-11(3)4/h10-12,15H,5-9H2,1-4H3