2-[dimethyl-(phenylmethyl)azaniumyl]ethyl (2-ethoxy-3-octadecoxy-propyl) phosphate

Systemtic Name: 2-[dimethyl-(phenylmethyl)azaniumyl]ethyl (2-ethoxy-3-octadecoxy-propyl) phosphate Openeye Name: 2-[benzyl(dimethyl)ammonio]ethyl (2-ethoxy-3-octadecoxy-propyl) phosphate CAS Name: 2-[dimethyl-(phenylmethyl)ammonio]ethyl (2-ethoxy-3-octadecoxypropyl) phosphate IUPAC Name: 2-[benzyl(dimethyl)azaniumyl]ethyl (2-ethoxy-3-octadecoxypropyl) phosphate Traditional Name: 2-[benzyl(dimethyl)ammonio]ethyl (2-ethoxy-3-stearyloxy-propyl) phosphate Formula: C34H64NO6P MolecularWeight: 613.848821

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC[N+](C)(C)CC1=CC=CC=C1)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC[N+](C)(C)CC1=CC=CC=C1)OCC

InChI

InChI=1S/C34H64NO6P/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-28-38-31-34(39-6-2)32-41-42(36,37)40-29-27-35(3,4)30-33-25-22-21-23-26-33/h21-23,25-26,34H,5-20,24,27-32H2,1-4H3