trimethyl-[2-[oxidanyl-[16-oxidanylidene-16-(2-propanoyloxypropoxy)hexadecan-4-yl]oxy-phosphoryl]oxyethyl]azanium

Systemtic Name: trimethyl-[2-[oxidanyl-[16-oxidanylidene-16-(2-propanoyloxypropoxy)hexadecan-4-yl]oxy-phosphoryl]oxyethyl]azanium Openeye Name: 2-[hydroxy-[13-oxo-13-(2-propanoyloxypropoxy)-1-propyl-tridecoxy]phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[16-oxo-16-[2-(1-oxopropoxy)propoxy]hexadecan-4-yl]oxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[hydroxy-[16-oxo-16-(2-propanoyloxypropoxy)hexadecan-4-yl]oxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[hydroxy-[13-keto-13-(2-propionyloxypropoxy)-1-propyl-tridecoxy]phosphoryl]oxyethyl-trimethyl-ammonium Formula: C27H55NO8P+ MolecularWeight: 552.701261

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCCCCCCCCCCC(=O)OCC(C)OC(=O)CC)OP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCC(CCCCCCCCCCCC(=O)OCC(C)OC(=O)CC)OP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C27H54NO8P/c1-7-18-25(36-37(31,32)34-22-21-28(4,5)6)19-16-14-12-10-9-11-13-15-17-20-27(30)33-23-24(3)35-26(29)8-2/h24-25H,7-23H2,1-6H3/p+1