2-[dimethylcarbamoyl-[2-methoxy-3-(octadecylcarbamoyloxy)propoxy]carbonyl-amino]ethyl-trimethyl-azanium iodide

Systemtic Name: 2-[dimethylcarbamoyl-[2-methoxy-3-(octadecylcarbamoyloxy)propoxy]carbonyl-amino]ethyl-trimethyl-azanium iodide Openeye Name: 2-[dimethylcarbamoyl-[2-methoxy-3-(octadecylcarbamoyloxy)propoxy]carbonyl-amino]ethyl-trimethyl-ammonium iodide CAS Name: 2-[[dimethylamino(oxo)methyl]-[[2-methoxy-3-[(octadecylamino)-oxomethoxy]propoxy]-oxomethyl]amino]ethyl-trimethylammonium iodide IUPAC Name: 2-[dimethylcarbamoyl-[2-methoxy-3-(octadecylcarbamoyloxy)propoxy]carbonylamino]ethyl-trimethylazanium iodide Traditional Name: 2-[dimethylcarbamoyl-[2-methoxy-3-(stearylcarbamoyloxy)propoxy]carbonyl-amino]ethyl-trimethyl-ammonium iodide Formula: C32H65IN4O6 MolecularWeight: 728.78617

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COC(=O)N(CC[N+](C)(C)C)C(=O)N(C)C)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COC(=O)N(CC[N+](C)(C)C)C(=O)N(C)C)OC.[I-]

InChI

InChI=1S/C32H64N4O6.HI/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-33-30(37)41-27-29(40-7)28-42-32(39)35(31(38)34(2)3)25-26-36(4,5)6;/h29H,8-28H2,1-7H3;1H