11-[ethyl-[2-[2-(11-sulfanylundecoxy)ethoxy]ethoxy]carbamoyl]oxyundecylphosphonic acid

Systemtic Name: 11-[ethyl-[2-[2-(11-sulfanylundecoxy)ethoxy]ethoxy]carbamoyl]oxyundecylphosphonic acid Openeye Name: 11-[ethyl-[2-[2-(11-sulfanylundecoxy)ethoxy]ethoxy]carbamoyl]oxyundecylphosphonic acid CAS Name: 11-[[ethyl-[2-[2-(11-mercaptoundecoxy)ethoxy]ethoxy]amino]-oxomethoxy]undecylphosphonic acid IUPAC Name: 11-[ethyl-[2-[2-(11-sulfanylundecoxy)ethoxy]ethoxy]carbamoyl]oxyundecylphosphonic acid Traditional Name: 11-[ethyl-[2-[2-(11-mercaptoundecoxy)ethoxy]ethoxy]carbamoyl]oxyundecylphosphonic acid Formula: C29H60NO8PS MolecularWeight: 613.827361

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)OCCCCCCCCCCCP(=O)(O)O)OCCOCCOCCCCCCCCCCCS

Isomeric SMILES

CCN(C(=O)OCCCCCCCCCCCP(=O)(O)O)OCCOCCOCCCCCCCCCCCS

InChI

InChI=1S/C29H60NO8PS/c1-2-30(29(31)37-22-18-14-10-6-3-7-11-15-19-27-39(32,33)34)38-26-25-36-24-23-35-21-17-13-9-5-4-8-12-16-20-28-40/h40H,2-28H2,1H3,(H2,32,33,34)