[3-[(1-ethyl-1-methyl-piperidin-1-ium-3-yl)carbamoyloxy]-2-methoxy-propyl] N-ethanoyl-N-octadecyl-carbamate iodide

Systemtic Name: [3-[(1-ethyl-1-methyl-piperidin-1-ium-3-yl)carbamoyloxy]-2-methoxy-propyl] N-ethanoyl-N-octadecyl-carbamate iodide Openeye Name: [3-[(1-ethyl-1-methyl-piperidin-1-ium-3-yl)carbamoyloxy]-2-methoxy-propyl] N-acetyl-N-octadecyl-carbamate iodide CAS Name: N-acetyl-N-octadecylcarbamic acid [3-[[(1-ethyl-1-methyl-3-piperidin-1-iumyl)amino]-oxomethoxy]-2-methoxypropyl] ester iodide IUPAC Name: [3-[(1-ethyl-1-methylpiperidin-1-ium-3-yl)carbamoyloxy]-2-methoxypropyl] N-acetyl-N-octadecylcarbamate iodide Traditional Name: N-acetyl-N-stearyl-carbamic acid [3-[(1-ethyl-1-methyl-piperidin-1-ium-3-yl)carbamoyloxy]-2-methoxy-propyl] ester iodide Formula: C34H66IN3O6 MolecularWeight: 739.80881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(C(=O)C)C(=O)OCC(COC(=O)NC1CCC[N+](C1)(C)CC)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(C(=O)C)C(=O)OCC(COC(=O)NC1CCC[N+](C1)(C)CC)OC.[I-]

InChI

InChI=1S/C34H65N3O6.HI/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-36(30(3)38)34(40)43-29-32(41-5)28-42-33(39)35-31-24-23-26-37(4,7-2)27-31;/h31-32H,6-29H2,1-5H3;1H