2-[ethanoyl-[1-[methoxy(octadecyl)carbamoyl]oxypropyl]carbamoyl]oxyethyl-trimethyl-azanium iodide

Systemtic Name: 2-[ethanoyl-[1-[methoxy(octadecyl)carbamoyl]oxypropyl]carbamoyl]oxyethyl-trimethyl-azanium iodide Openeye Name: 2-[acetyl-[1-[methoxy(octadecyl)carbamoyl]oxypropyl]carbamoyl]oxyethyl-trimethyl-ammonium iodide CAS Name: 2-[[acetyl-[1-[[methoxy(octadecyl)amino]-oxomethoxy]propyl]amino]-oxomethoxy]ethyl-trimethylammonium iodide IUPAC Name: 2-[acetyl-[1-[methoxy(octadecyl)carbamoyl]oxypropyl]carbamoyl]oxyethyl-trimethylazanium iodide Traditional Name: 2-[acetyl-[1-[methoxy(stearyl)carbamoyl]oxypropyl]carbamoyl]oxyethyl-trimethyl-ammonium iodide Formula: C31H62IN3O6 MolecularWeight: 699.74495

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H62N3O6.HI/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-32(38-7)30(36)40-29(9-2)33(28(3)35)31(37)39-27-26-34(4,5)6;/h29H,8-27H2,1-7H3;1H/q+1;/p-1