2-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]-1-(phenylmethyl)benzimidazole

Systemtic Name: 2-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]-1-(phenylmethyl)benzimidazole Openeye Name: 1-benzyl-2-[(E)-2-(1-methylpyridin-1-ium-2-yl)vinyl]benzimidazole CAS Name: 2-[(E)-2-(1-methyl-2-pyridin-1-iumyl)ethenyl]-1-(phenylmethyl)benzimidazole IUPAC Name: 1-benzyl-2-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]benzimidazole Traditional Name: 1-benzyl-2-[(E)-2-(1-methylpyridin-1-ium-2-yl)vinyl]benzimidazole Formula: C22H20N3+ MolecularWeight: 326.4143

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1C=CC2=NC3=CC=CC=C3N2CC4=CC=CC=C4

Isomeric SMILES

C[N+]1=CC=CC=C1/C=C/C2=NC3=CC=CC=C3N2CC4=CC=CC=C4

InChI

InChI=1S/C22H20N3/c1-24-16-8-7-11-19(24)14-15-22-23-20-12-5-6-13-21(20)25(22)17-18-9-3-2-4-10-18/h2-16H,17H2,1H3/q+1