2-methyl-2-(2-methyl-1-oxidanidyl-1-oxidanylidene-dodecan-2-yl)sulfanyl-dodecanoate

Systemtic Name: 2-methyl-2-(2-methyl-1-oxidanidyl-1-oxidanylidene-dodecan-2-yl)sulfanyl-dodecanoate Openeye Name: 2-(1-carboxylato-1-methyl-undecyl)sulfanyl-2-methyl-dodecanoate CAS Name: 2-methyl-2-[(2-methyl-1-oxido-1-oxododecan-2-yl)thio]dodecanoate IUPAC Name: 2-methyl-2-(2-methyl-1-oxido-1-oxododecan-2-yl)sulfanyldodecanoate Traditional Name: 2-[(1-carboxylato-1-methyl-undecyl)thio]-2-methyl-laurate Formula: C26H48O4S-2 MolecularWeight: 456.72192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C)(C(=O)[O-])SC(C)(CCCCCCCCCC)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCC(C)(C(=O)[O-])SC(C)(CCCCCCCCCC)C(=O)[O-]

InChI

InChI=1S/C26H50O4S/c1-5-7-9-11-13-15-17-19-21-25(3,23(27)28)31-26(4,24(29)30)22-20-18-16-14-12-10-8-6-2/h5-22H2,1-4H3,(H,27,28)(H,29,30)/p-2