2-methylpropyl 4-(2-methylpropylsulfanyl)-2-oxidanyl-4-oxidanylidene-butanoate

Systemtic Name: 2-methylpropyl 4-(2-methylpropylsulfanyl)-2-oxidanyl-4-oxidanylidene-butanoate Openeye Name: isobutyl 2-hydroxy-4-isobutylsulfanyl-4-oxo-butanoate CAS Name: 2-hydroxy-4-(2-methylpropylthio)-4-oxobutanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-hydroxy-4-(2-methylpropylsulfanyl)-4-oxobutanoate Traditional Name: 2-hydroxy-4-(isobutylthio)-4-keto-butyric acid isobutyl ester Formula: C12H22O4S MolecularWeight: 262.36568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(CC(=O)SCC(C)C)O

Isomeric SMILES

CC(C)COC(=O)C(CC(=O)SCC(C)C)O

InChI

InChI=1S/C12H22O4S/c1-8(2)6-16-12(15)10(13)5-11(14)17-7-9(3)4/h8-10,13H,5-7H2,1-4H3