4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]benzenecarbonitrile iodide

Systemtic Name: 4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]benzenecarbonitrile iodide Openeye Name: 4-[(E)-2-(1-methylpyridin-1-ium-2-yl)vinyl]benzonitrile iodide CAS Name: 4-[(E)-2-(1-methyl-2-pyridin-1-iumyl)ethenyl]benzonitrile iodide IUPAC Name: 4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]benzonitrile iodide Traditional Name: 4-[(E)-2-(1-methylpyridin-1-ium-2-yl)vinyl]benzonitrile iodide Formula: C15H13IN2 MolecularWeight: 348.18159

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1C=CC2=CC=C(C=C2)C#N.[I-]

Isomeric SMILES

C[N+]1=CC=CC=C1/C=C/C2=CC=C(C=C2)C#N.[I-]

InChI

InChI=1S/C15H13N2.HI/c1-17-11-3-2-4-15(17)10-9-13-5-7-14(12-16)8-6-13;/h2-11H,1H3;1H/q+1;/p-1/b10-9+;