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

Systemtic Name: trimethyl-[2-[[3-(octadecanoylamino)-2-octoxy-propoxy]-oxidanyl-phosphoryl]oxyethyl]azanium Openeye Name: 2-[hydroxy-[3-(octadecanoylamino)-2-octoxy-propoxy]phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[2-octoxy-3-(1-oxooctadecylamino)propoxy]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[hydroxy-[3-(octadecanoylamino)-2-octoxypropoxy]phosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[hydroxy-(2-octoxy-3-stearamido-propoxy)phosphoryl]oxyethyl-trimethyl-ammonium Formula: C34H72N2O6P+ MolecularWeight: 635.919041

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H71N2O6P/c1-6-8-10-12-14-15-16-17-18-19-20-21-22-23-25-27-34(37)35-31-33(40-29-26-24-13-11-9-7-2)32-42-43(38,39)41-30-28-36(3,4)5/h33H,6-32H2,1-5H3,(H-,35,37,38,39)/p+1