2-[2-(hexadecylcarbamoyloxy)icosoxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[2-(hexadecylcarbamoyloxy)icosoxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[2-(hexadecylcarbamoyloxy)icosoxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[2-[(hexadecylamino)-oxomethoxy]eicosoxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[2-(hexadecylcarbamoyloxy)icosoxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[2-(cetylcarbamoyloxy)eicosoxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C42H88N2O6P+ MolecularWeight: 748.131681

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)NCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)NCCCCCCCCCCCCCCCC

InChI

InChI=1S/C42H87N2O6P/c1-6-8-10-12-14-16-18-20-22-23-24-26-28-30-32-34-36-41(40-49-51(46,47)48-39-38-44(3,4)5)50-42(45)43-37-35-33-31-29-27-25-21-19-17-15-13-11-9-7-2/h41H,6-40H2,1-5H3,(H-,43,45,46,47)/p+1