2-decyl-2-(2-methyl-1-oxidanidyl-1-oxidanylidene-dodecan-2-yl)sulfanyl-tridecanoate

Systemtic Name: 2-decyl-2-(2-methyl-1-oxidanidyl-1-oxidanylidene-dodecan-2-yl)sulfanyl-tridecanoate Openeye Name: 2-(1-carboxylato-1-methyl-undecyl)sulfanyl-2-decyl-tridecanoate CAS Name: 2-decyl-2-[(2-methyl-1-oxido-1-oxododecan-2-yl)thio]tridecanoate IUPAC Name: 2-decyl-2-(2-methyl-1-oxido-1-oxododecan-2-yl)sulfanyltridecanoate Traditional Name: 2-[(1-carboxylato-1-methyl-undecyl)thio]-2-decyl-tridecanoate Formula: C36H68O4S-2 MolecularWeight: 596.98772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C36H70O4S/c1-5-8-11-14-17-20-23-26-29-32-36(34(39)40,31-28-25-22-19-16-13-10-7-3)41-35(4,33(37)38)30-27-24-21-18-15-12-9-6-2/h5-32H2,1-4H3,(H,37,38)(H,39,40)/p-2