magnesium; 4-tert-butylsulfanyl-2-methyl-4-oxidanylidene-butanoate; 3-tert-butylsulfanyl-2-methyl-3-oxidanylidene-propanoate

Systemtic Name: magnesium; 4-tert-butylsulfanyl-2-methyl-4-oxidanylidene-butanoate; 3-tert-butylsulfanyl-2-methyl-3-oxidanylidene-propanoate Openeye Name: magnesium; 4-tert-butylsulfanyl-2-methyl-4-oxo-butanoate; 3-tert-butylsulfanyl-2-methyl-3-oxo-propanoate CAS Name: magnesium; 4-(tert-butylthio)-2-methyl-4-oxobutanoate; 3-(tert-butylthio)-2-methyl-3-oxopropanoate IUPAC Name: magnesium; 4-tert-butylsulfanyl-2-methyl-4-oxobutanoate; 3-tert-butylsulfanyl-2-methyl-3-oxopropanoate Traditional Name: magnesium; 4-(tert-butylthio)-4-keto-2-methyl-butyrate; 3-(tert-butylthio)-3-keto-2-methyl-propionate Formula: C17H28MgO6S2 MolecularWeight: 416.83562

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)SC(C)(C)C)C(=O)[O-].CC(C(=O)[O-])C(=O)SC(C)(C)C.[Mg+2]

Isomeric SMILES

CC(CC(=O)SC(C)(C)C)C(=O)[O-].CC(C(=O)[O-])C(=O)SC(C)(C)C.[Mg+2]

InChI

InChI=1S/C9H16O3S.C8H14O3S.Mg/c1-6(8(11)12)5-7(10)13-9(2,3)4;1-5(6(9)10)7(11)12-8(2,3)4;/h6H,5H2,1-4H3,(H,11,12);5H,1-4H3,(H,9,10);/q;;+2/p-2