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

Systemtic Name: 2-[[2-methoxy-3-(octadecylcarbamoyloxy)propoxy]carbonyl-(propylcarbamoyl)amino]ethyl-trimethyl-azanium iodide Openeye Name: 2-[[2-methoxy-3-(octadecylcarbamoyloxy)propoxy]carbonyl-(propylcarbamoyl)amino]ethyl-trimethyl-ammonium iodide CAS Name: 2-[[[2-methoxy-3-[(octadecylamino)-oxomethoxy]propoxy]-oxomethyl]-[oxo(propylamino)methyl]amino]ethyl-trimethylammonium iodide IUPAC Name: 2-[[2-methoxy-3-(octadecylcarbamoyloxy)propoxy]carbonyl-(propylcarbamoyl)amino]ethyl-trimethylazanium iodide Traditional Name: 2-[[2-methoxy-3-(stearylcarbamoyloxy)propoxy]carbonyl-(propylcarbamoyl)amino]ethyl-trimethyl-ammonium iodide Formula: C33H67IN4O6 MolecularWeight: 742.81275

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H66N4O6.HI/c1-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-35-32(39)42-28-30(41-6)29-43-33(40)36(26-27-37(3,4)5)31(38)34-24-8-2;/h30H,7-29H2,1-6H3,(H-,34,35,38,39);1H