[3-[2,3-di(hexadecanoyloxy)propoxy-oxidanyl-phosphoryl]oxy-3-oxidanyl-propyl]-hexyl-dimethyl-azanium

Systemtic Name: [3-[2,3-di(hexadecanoyloxy)propoxy-oxidanyl-phosphoryl]oxy-3-oxidanyl-propyl]-hexyl-dimethyl-azanium Openeye Name: [3-[2,3-di(hexadecanoyloxy)propoxy-hydroxy-phosphoryl]oxy-3-hydroxy-propyl]-hexyl-dimethyl-ammonium CAS Name: [3-[2,3-bis(1-oxohexadecoxy)propoxy-hydroxyphosphoryl]oxy-3-hydroxypropyl]-hexyl-dimethylammonium IUPAC Name: [3-[2,3-di(hexadecanoyloxy)propoxy-hydroxyphosphoryl]oxy-3-hydroxypropyl]-hexyl-dimethylazanium Traditional Name: [3-[2,3-di(hexadecanoyloxy)propoxy-hydroxy-phosphoryl]oxy-3-hydroxy-propyl]-hexyl-dimethyl-ammonium Formula: C46H93NO9P+ MolecularWeight: 835.205681

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OC(CC[N+](C)(C)CCCCCC)O)OC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OC(CC[N+](C)(C)CCCCCC)O)OC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C46H92NO9P/c1-6-9-12-15-17-19-21-23-25-27-29-31-33-36-44(48)53-41-43(55-45(49)37-34-32-30-28-26-24-22-20-18-16-13-10-7-2)42-54-57(51,52)56-46(50)38-40-47(4,5)39-35-14-11-8-3/h43,46,50H,6-42H2,1-5H3/p+1