trimethyl-[2-[(3-octadecanoyloxy-2-tridecanoyloxy-propoxy)-oxidanyl-phosphoryl]oxyethyl]azanium

Systemtic Name: trimethyl-[2-[(3-octadecanoyloxy-2-tridecanoyloxy-propoxy)-oxidanyl-phosphoryl]oxyethyl]azanium Openeye Name: 2-[hydroxy-(3-octadecanoyloxy-2-tridecanoyloxy-propoxy)phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[3-(1-oxooctadecoxy)-2-(1-oxotridecoxy)propoxy]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[hydroxy-(3-octadecanoyloxy-2-tridecanoyloxypropoxy)phosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[hydroxy-(3-stearoyloxy-2-tridecanoyloxy-propoxy)phosphoryl]oxyethyl-trimethyl-ammonium Formula: C39H79NO8P+ MolecularWeight: 721.020221

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C39H78NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-24-25-27-29-31-38(41)45-35-37(36-47-49(43,44)46-34-33-40(3,4)5)48-39(42)32-30-28-26-23-17-15-13-11-9-7-2/h37H,6-36H2,1-5H3/p+1