2-[(E)-2-(1-butylpyridin-1-ium-2-yl)ethenyl]-5,6-dimethyl-1H-benzimidazole

Systemtic Name: 2-[(E)-2-(1-butylpyridin-1-ium-2-yl)ethenyl]-5,6-dimethyl-1H-benzimidazole Openeye Name: 2-[(E)-2-(1-butylpyridin-1-ium-2-yl)vinyl]-5,6-dimethyl-1H-benzimidazole CAS Name: 2-[(E)-2-(1-butyl-2-pyridin-1-iumyl)ethenyl]-5,6-dimethyl-1H-benzimidazole IUPAC Name: 2-[(E)-2-(1-butylpyridin-1-ium-2-yl)ethenyl]-5,6-dimethyl-1H-benzimidazole Traditional Name: 2-[(E)-2-(1-butylpyridin-1-ium-2-yl)vinyl]-5,6-dimethyl-1H-benzimidazole Formula: C20H24N3+ MolecularWeight: 306.42466

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CC=CC=C1C=CC2=NC3=C(N2)C=C(C(=C3)C)C

Isomeric SMILES

CCCC[N+]1=CC=CC=C1/C=C/C2=NC3=C(N2)C=C(C(=C3)C)C

InChI

InChI=1S/C20H23N3/c1-4-5-11-23-12-7-6-8-17(23)9-10-20-21-18-13-15(2)16(3)14-19(18)22-20/h6-10,12-14H,4-5,11H2,1-3H3/p+1