[2-methoxy-3-(octadecylcarbamoyloxy)propyl] N-methoxycarbonyl-N-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]carbamate iodide

Systemtic Name: [2-methoxy-3-(octadecylcarbamoyloxy)propyl] N-methoxycarbonyl-N-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]carbamate iodide Openeye Name: [2-methoxy-3-(octadecylcarbamoyloxy)propyl] N-methoxycarbonyl-N-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]carbamate iodide CAS Name: N-methoxycarbonyl-N-[2-(1-methyl-1-pyrrolidin-1-iumyl)ethyl]carbamic acid [2-methoxy-3-[(octadecylamino)-oxomethoxy]propyl] ester iodide IUPAC Name: [2-methoxy-3-(octadecylcarbamoyloxy)propyl] N-methoxycarbonyl-N-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]carbamate iodide Traditional Name: N-carbomethoxy-N-[2-(1-methylpyrrolidin-1-ium-1-yl)ethyl]carbamic acid [2-methoxy-3-(stearylcarbamoyloxy)propyl] ester iodide Formula: C33H64IN3O7 MolecularWeight: 741.78163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COC(=O)N(CC[N+]1(CCCC1)C)C(=O)OC)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COC(=O)N(CC[N+]1(CCCC1)C)C(=O)OC)OC.[I-]

InChI

InChI=1S/C33H63N3O7.HI/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-34-31(37)42-28-30(40-3)29-43-33(39)35(32(38)41-4)24-27-36(2)25-21-22-26-36;/h30H,5-29H2,1-4H3;1H