2-[2,3-bis(4-dodecylhexadecanoyloxy)propoxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[2,3-bis(4-dodecylhexadecanoyloxy)propoxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[2,3-bis(4-dodecylhexadecanoyloxy)propoxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[2,3-bis(4-dodecyl-1-oxohexadecoxy)propoxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[2,3-bis(4-dodecylhexadecanoyloxy)propoxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[2,3-bis(4-laurylhexadecanoyloxy)propoxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C64H129NO8P+ MolecularWeight: 1071.684721

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCCCCCCCCC)CCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCC(CCCCCCCCCCCC)CCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC(CCCCCCCCCCCC)CCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCC(CCCCCCCCCCCC)CCCCCCCCCCCC

InChI

InChI=1S/C64H128NO8P/c1-8-12-16-20-24-28-32-36-40-44-48-60(49-45-41-37-33-29-25-21-17-13-9-2)52-54-63(66)70-58-62(59-72-74(68,69)71-57-56-65(5,6)7)73-64(67)55-53-61(50-46-42-38-34-30-26-22-18-14-10-3)51-47-43-39-35-31-27-23-19-15-11-4/h60-62H,8-59H2,1-7H3/p+1