sodium 11-(23-dodecylsulfanyltricosanoylamino)undecanoate

Systemtic Name: sodium 11-(23-dodecylsulfanyltricosanoylamino)undecanoate Openeye Name: sodium 11-(23-dodecylsulfanyltricosanoylamino)undecanoate CAS Name: sodium 11-[[23-(dodecylthio)-1-oxotricosyl]amino]undecanoate IUPAC Name: sodium 11-(23-dodecylsulfanyltricosanoylamino)undecanoate Traditional Name: sodium 11-[23-(laurylthio)tricosanoylamino]undecanoate Formula: C46H90NNaO3S MolecularWeight: 760.26647

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCCCCCCCCCCCCCCCCCCCCCCC(=O)NCCCCCCCCCCC(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCCSCCCCCCCCCCCCCCCCCCCCCCC(=O)NCCCCCCCCCCC(=O)[O-].[Na+]

InChI

InChI=1S/C46H91NO3S.Na/c1-2-3-4-5-6-7-23-28-33-38-43-51-44-39-34-29-24-19-17-15-13-11-9-8-10-12-14-16-18-20-25-30-35-40-45(48)47-42-37-32-27-22-21-26-31-36-41-46(49)50;/h2-44H2,1H3,(H,47,48)(H,49,50);/q;+1/p-1