2-octyl-2-[(3-oxidanidyl-3-oxidanylidene-propyl)sulfanylmethyl]decanoate

Systemtic Name: 2-octyl-2-[(3-oxidanidyl-3-oxidanylidene-propyl)sulfanylmethyl]decanoate Openeye Name: 2-octyl-2-[(3-oxido-3-oxo-propyl)sulfanylmethyl]decanoate CAS Name: 2-octyl-2-[[(3-oxido-3-oxopropyl)thio]methyl]decanoate IUPAC Name: 2-octyl-2-[(3-oxido-3-oxopropyl)sulfanylmethyl]decanoate Traditional Name: 2-[[(3-keto-3-oxido-propyl)thio]methyl]-2-octyl-caprate Formula: C22H40O4S-2 MolecularWeight: 400.6156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCCCC)(CSCCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCCCCCCC(CCCCCCCC)(CSCCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C22H42O4S/c1-3-5-7-9-11-13-16-22(21(25)26,19-27-18-15-20(23)24)17-14-12-10-8-6-4-2/h3-19H2,1-2H3,(H,23,24)(H,25,26)/p-2