1-butyl-3-[3-(3-butylimidazol-3-ium-1-yl)phenyl]imidazol-1-ium diiodide

Systemtic Name: 1-butyl-3-[3-(3-butylimidazol-3-ium-1-yl)phenyl]imidazol-1-ium diiodide Openeye Name: 1-butyl-3-[3-(3-butylimidazol-3-ium-1-yl)phenyl]imidazol-1-ium diiodide CAS Name: 1-butyl-3-[3-(3-butyl-1-imidazol-3-iumyl)phenyl]imidazol-1-ium diiodide IUPAC Name: 1-butyl-3-[3-(3-butylimidazol-3-ium-1-yl)phenyl]imidazol-1-ium diiodide Traditional Name: 1-butyl-3-[3-(3-butylimidazol-3-ium-1-yl)phenyl]imidazol-1-ium diiodide Formula: C20H28I2N4 MolecularWeight: 578.27206

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CN(C=C1)C2=CC(=CC=C2)N3C=C[N+](=C3)CCCC.[I-].[I-]

Isomeric SMILES

CCCC[N+]1=CN(C=C1)C2=CC(=CC=C2)N3C=C[N+](=C3)CCCC.[I-].[I-]

InChI

InChI=1S/C20H28N4.2HI/c1-3-5-10-21-12-14-23(17-21)19-8-7-9-20(16-19)24-15-13-22(18-24)11-6-4-2;;/h7-9,12-18H,3-6,10-11H2,1-2H3;2*1H/q+2;;/p-2