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

Systemtic Name: 1-(4,4-dimethylpiperazin-4-ium-1-yl)hexadecan-1-one iodide Openeye Name: 1-(4,4-dimethylpiperazin-4-ium-1-yl)hexadecan-1-one iodide CAS Name: 1-(4,4-dimethyl-1-piperazin-4-iumyl)-1-hexadecanone iodide IUPAC Name: 1-(4,4-dimethylpiperazin-4-ium-1-yl)hexadecan-1-one iodide Traditional Name: 1-(4,4-dimethylpiperazin-4-ium-1-yl)hexadecan-1-one iodide Formula: C22H45IN2O MolecularWeight: 480.50997

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H45N2O.HI/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(25)23-18-20-24(2,3)21-19-23;/h4-21H2,1-3H3;1H/q+1;/p-1