1-heptylpyridin-1-ium-2-carbonitrile iodide

Systemtic Name: 1-heptylpyridin-1-ium-2-carbonitrile iodide Openeye Name: 1-heptylpyridin-1-ium-2-carbonitrile iodide CAS Name: 1-heptyl-2-pyridin-1-iumcarbonitrile iodide IUPAC Name: 1-heptylpyridin-1-ium-2-carbonitrile iodide Traditional Name: 1-heptylpyridin-1-ium-2-carbonitrile iodide Formula: C13H19IN2 MolecularWeight: 330.20783

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+]1=CC=CC=C1C#N.[I-]

Isomeric SMILES

CCCCCCC[N+]1=CC=CC=C1C#N.[I-]

InChI

InChI=1S/C13H19N2.HI/c1-2-3-4-5-7-10-15-11-8-6-9-13(15)12-14;/h6,8-9,11H,2-5,7,10H2,1H3;1H/q+1;/p-1