2-(2,4,6-triphenylpyridin-1-ium-1-yl)-1H-benzimidazole iodide

Systemtic Name: 2-(2,4,6-triphenylpyridin-1-ium-1-yl)-1H-benzimidazole iodide Openeye Name: 2-(2,4,6-triphenylpyridin-1-ium-1-yl)-1H-benzimidazole iodide CAS Name: 2-(2,4,6-triphenyl-1-pyridin-1-iumyl)-1H-benzimidazole iodide IUPAC Name: 2-(2,4,6-triphenylpyridin-1-ium-1-yl)-1H-benzimidazole iodide Traditional Name: 2-(2,4,6-triphenylpyridin-1-ium-1-yl)-1H-benzimidazole iodide Formula: C30H22IN3 MolecularWeight: 551.42025

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3)C4=NC5=CC=CC=C5N4)C6=CC=CC=C6.[I-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3)C4=NC5=CC=CC=C5N4)C6=CC=CC=C6.[I-]

InChI

InChI=1S/C30H22N3.HI/c1-4-12-22(13-5-1)25-20-28(23-14-6-2-7-15-23)33(29(21-25)24-16-8-3-9-17-24)30-31-26-18-10-11-19-27(26)32-30;/h1-21H,(H,31,32);1H/q+1;/p-1