2-methyl-2-(2-methyl-1-oxidanidyl-1-oxidanylidene-heptan-2-yl)sulfanyl-heptanoate

Systemtic Name: 2-methyl-2-(2-methyl-1-oxidanidyl-1-oxidanylidene-heptan-2-yl)sulfanyl-heptanoate Openeye Name: 2-(1-carboxylato-1-methyl-hexyl)sulfanyl-2-methyl-heptanoate CAS Name: 2-methyl-2-[(2-methyl-1-oxido-1-oxoheptan-2-yl)thio]heptanoate IUPAC Name: 2-methyl-2-(2-methyl-1-oxido-1-oxoheptan-2-yl)sulfanylheptanoate Traditional Name: 2-[(1-carboxylato-1-methyl-hexyl)thio]-2-methyl-enanthate Formula: C16H28O4S-2 MolecularWeight: 316.45612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C(=O)[O-])SC(C)(CCCCC)C(=O)[O-]

Isomeric SMILES

CCCCCC(C)(C(=O)[O-])SC(C)(CCCCC)C(=O)[O-]

InChI

InChI=1S/C16H30O4S/c1-5-7-9-11-15(3,13(17)18)21-16(4,14(19)20)12-10-8-6-2/h5-12H2,1-4H3,(H,17,18)(H,19,20)/p-2