trimethyl-[2-[[3-(octadecanoylamino)-2-tridecoxy-propoxy]-oxidanyl-phosphoryl]oxyethyl]azanium

Systemtic Name: trimethyl-[2-[[3-(octadecanoylamino)-2-tridecoxy-propoxy]-oxidanyl-phosphoryl]oxyethyl]azanium Openeye Name: 2-[hydroxy-[3-(octadecanoylamino)-2-tridecoxy-propoxy]phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[3-(1-oxooctadecylamino)-2-tridecoxypropoxy]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[hydroxy-[3-(octadecanoylamino)-2-tridecoxypropoxy]phosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[hydroxy-(3-stearamido-2-tridecoxy-propoxy)phosphoryl]oxyethyl-trimethyl-ammonium Formula: C39H82N2O6P+ MolecularWeight: 706.051941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCC(COP(=O)(O)OCC[N+](C)(C)C)OCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCC(COP(=O)(O)OCC[N+](C)(C)C)OCCCCCCCCCCCCC

InChI

InChI=1S/C39H81N2O6P/c1-6-8-10-12-14-16-18-19-20-21-22-24-26-28-30-32-39(42)40-36-38(37-47-48(43,44)46-35-33-41(3,4)5)45-34-31-29-27-25-23-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3,(H-,40,42,43,44)/p+1