dodecyl-(1-iodanylprop-2-ynyl)-dioctyl-azanium chloride

Systemtic Name: dodecyl-(1-iodanylprop-2-ynyl)-dioctyl-azanium chloride Openeye Name: dodecyl-(1-iodoprop-2-ynyl)-dioctyl-ammonium chloride CAS Name: dodecyl-(1-iodoprop-2-ynyl)-dioctylammonium chloride IUPAC Name: dodecyl-(1-iodoprop-2-ynyl)-dioctylazanium chloride Traditional Name: 1-iodoprop-2-ynyl-lauryl-dioctyl-ammonium chloride Formula: C31H61ClIN MolecularWeight: 610.18021

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H61IN.ClH/c1-5-9-12-15-18-19-20-21-24-27-30-33(31(32)8-4,28-25-22-16-13-10-6-2)29-26-23-17-14-11-7-3;/h4,31H,5-7,9-30H2,1-3H3;1H/q+1;/p-1