2-(3-butylimidazol-3-ium-1-yl)-6-pyrazol-1-yl-pyridine iodide

Systemtic Name: 2-(3-butylimidazol-3-ium-1-yl)-6-pyrazol-1-yl-pyridine iodide Openeye Name: 2-(3-butylimidazol-3-ium-1-yl)-6-pyrazol-1-yl-pyridine iodide CAS Name: 2-(3-butyl-1-imidazol-3-iumyl)-6-(1-pyrazolyl)pyridine iodide IUPAC Name: 2-(3-butylimidazol-3-ium-1-yl)-6-pyrazol-1-ylpyridine iodide Traditional Name: 2-(3-butylimidazol-3-ium-1-yl)-6-pyrazol-1-yl-pyridine iodide Formula: C15H18IN5 MolecularWeight: 395.24139

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CN(C=C1)C2=NC(=CC=C2)N3C=CC=N3.[I-]

Isomeric SMILES

CCCC[N+]1=CN(C=C1)C2=NC(=CC=C2)N3C=CC=N3.[I-]

InChI

InChI=1S/C15H18N5.HI/c1-2-3-9-18-11-12-19(13-18)14-6-4-7-15(17-14)20-10-5-8-16-20;/h4-8,10-13H,2-3,9H2,1H3;1H/q+1;/p-1