(2-acetyloxy-3-octadecoxy-propyl) (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl)methyl phosphate

Systemtic Name: (2-acetyloxy-3-octadecoxy-propyl) (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl)methyl phosphate Openeye Name: (2-acetoxy-3-octadecoxy-propyl) (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl)methyl phosphate CAS Name: (2-acetyloxy-3-octadecoxypropyl) (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl)methyl phosphate IUPAC Name: (2-acetyloxy-3-octadecoxypropyl) (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl)methyl phosphate Traditional Name: (2-acetoxy-3-stearyloxy-propyl) (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl)methyl phosphate Formula: C33H64NO7P MolecularWeight: 617.837521

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC1CC2CCC(C1)[N+]2(C)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC1CC2CCC(C1)[N+]2(C)C)OC(=O)C

InChI

InChI=1S/C33H64NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-38-27-33(41-29(2)35)28-40-42(36,37)39-26-30-24-31-21-22-32(25-30)34(31,3)4/h30-33H,5-28H2,1-4H3