dimethyl-[2-[3-(octadecanoylamino)propoxy-oxidanyl-phosphoryl]oxyethyl]-(3-oxidanylpropyl)azanium

Systemtic Name: dimethyl-[2-[3-(octadecanoylamino)propoxy-oxidanyl-phosphoryl]oxyethyl]-(3-oxidanylpropyl)azanium Openeye Name: 2-[hydroxy-[3-(octadecanoylamino)propoxy]phosphoryl]oxyethyl-(3-hydroxypropyl)-dimethyl-ammonium CAS Name: 2-[hydroxy-[3-(1-oxooctadecylamino)propoxy]phosphoryl]oxyethyl-(3-hydroxypropyl)-dimethylammonium IUPAC Name: 2-[hydroxy-[3-(octadecanoylamino)propoxy]phosphoryl]oxyethyl-(3-hydroxypropyl)-dimethylazanium Traditional Name: 3-hydroxypropyl-[2-[hydroxy(3-stearamidopropoxy)phosphoryl]oxyethyl]-dimethyl-ammonium Formula: C28H60N2O6P+ MolecularWeight: 551.759561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCCCOP(=O)(O)OCC[N+](C)(C)CCCO

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCCCOP(=O)(O)OCC[N+](C)(C)CCCO

InChI

InChI=1S/C28H59N2O6P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-28(32)29-22-19-26-35-37(33,34)36-27-24-30(2,3)23-20-25-31/h31H,4-27H2,1-3H3,(H-,29,32,33,34)/p+1