2-(3-methylimidazol-3-ium-1-yl)benzenecarbonitrile iodide

Systemtic Name: 2-(3-methylimidazol-3-ium-1-yl)benzenecarbonitrile iodide Openeye Name: 2-(3-methylimidazol-3-ium-1-yl)benzonitrile iodide CAS Name: 2-(3-methyl-1-imidazol-3-iumyl)benzonitrile iodide IUPAC Name: 2-(3-methylimidazol-3-ium-1-yl)benzonitrile iodide Traditional Name: 2-(3-methylimidazol-3-ium-1-yl)benzonitrile iodide Formula: C11H10IN3 MolecularWeight: 311.12167

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)C2=CC=CC=C2C#N.[I-]

Isomeric SMILES

C[N+]1=CN(C=C1)C2=CC=CC=C2C#N.[I-]

InChI

InChI=1S/C11H10N3.HI/c1-13-6-7-14(9-13)11-5-3-2-4-10(11)8-12;/h2-7,9H,1H3;1H/q+1;/p-1