1,5,6-trimethyl-2-(2,4,6-triphenylpyridin-1-ium-1-yl)benzimidazole iodide

Systemtic Name: 1,5,6-trimethyl-2-(2,4,6-triphenylpyridin-1-ium-1-yl)benzimidazole iodide Openeye Name: 1,5,6-trimethyl-2-(2,4,6-triphenylpyridin-1-ium-1-yl)benzimidazole iodide CAS Name: 1,5,6-trimethyl-2-(2,4,6-triphenyl-1-pyridin-1-iumyl)benzimidazole iodide IUPAC Name: 1,5,6-trimethyl-2-(2,4,6-triphenylpyridin-1-ium-1-yl)benzimidazole iodide Traditional Name: 1,5,6-trimethyl-2-(2,4,6-triphenylpyridin-1-ium-1-yl)benzimidazole iodide Formula: C33H28IN3 MolecularWeight: 593.49999

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)[N+]3=C(C=C(C=C3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)C.[I-]

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)[N+]3=C(C=C(C=C3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)C.[I-]

InChI

InChI=1S/C33H28N3.HI/c1-23-19-29-32(20-24(23)2)35(3)33(34-29)36-30(26-15-9-5-10-16-26)21-28(25-13-7-4-8-14-25)22-31(36)27-17-11-6-12-18-27;/h4-22H,1-3H3;1H/q+1;/p-1