1-methyl-1-(3-octadecoxypropyl)piperazin-1-ium iodide

Systemtic Name: 1-methyl-1-(3-octadecoxypropyl)piperazin-1-ium iodide Openeye Name: 1-methyl-1-(3-octadecoxypropyl)piperazin-1-ium iodide CAS Name: 1-methyl-1-(3-octadecoxypropyl)piperazin-1-ium iodide IUPAC Name: 1-methyl-1-(3-octadecoxypropyl)piperazin-1-ium iodide Traditional Name: 1-methyl-1-(3-stearyloxypropyl)piperazin-1-ium iodide Formula: C26H55IN2O MolecularWeight: 538.63217

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCCC[N+]1(CCNCC1)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCCC[N+]1(CCNCC1)C.[I-]

InChI

InChI=1S/C26H55N2O.HI/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-29-26-19-22-28(2)23-20-27-21-24-28;/h27H,3-26H2,1-2H3;1H/q+1;/p-1