5-cyanopentyl-didodecyl-methyl-azanium iodide

Systemtic Name: 5-cyanopentyl-didodecyl-methyl-azanium iodide Openeye Name: 5-cyanopentyl-didodecyl-methyl-ammonium iodide CAS Name: 5-cyanopentyl-didodecyl-methylammonium iodide IUPAC Name: 5-cyanopentyl-didodecyl-methylazanium iodide Traditional Name: 5-cyanopentyl-dilauryl-methyl-ammonium iodide Formula: C31H63IN2 MolecularWeight: 590.74979

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](C)(CCCCCCCCCCCC)CCCCCC#N.[I-]

Isomeric SMILES

CCCCCCCCCCCC[N+](C)(CCCCCCCCCCCC)CCCCCC#N.[I-]

InChI

InChI=1S/C31H63N2.HI/c1-4-6-8-10-12-14-16-18-21-25-29-33(3,31-27-23-20-24-28-32)30-26-22-19-17-15-13-11-9-7-5-2;/h4-27,29-31H2,1-3H3;1H/q+1;/p-1