1-(4,4-dimethylpiperazin-4-ium-1-yl)docosan-1-one iodide

Systemtic Name: 1-(4,4-dimethylpiperazin-4-ium-1-yl)docosan-1-one iodide Openeye Name: 1-(4,4-dimethylpiperazin-4-ium-1-yl)docosan-1-one iodide CAS Name: 1-(4,4-dimethyl-1-piperazin-4-iumyl)-1-docosanone iodide IUPAC Name: 1-(4,4-dimethylpiperazin-4-ium-1-yl)docosan-1-one iodide Traditional Name: 1-(4,4-dimethylpiperazin-4-ium-1-yl)docosan-1-one iodide Formula: C28H57IN2O MolecularWeight: 564.66945

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)N1CC[N+](CC1)(C)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)N1CC[N+](CC1)(C)C.[I-]

InChI

InChI=1S/C28H57N2O.HI/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-28(31)29-24-26-30(2,3)27-25-29;/h4-27H2,1-3H3;1H/q+1;/p-1