3-[(4-methylphenyl)methyl]-2-(2-methylpropyl)-1H-benzimidazol-3-ium

Systemtic Name: 3-[(4-methylphenyl)methyl]-2-(2-methylpropyl)-1H-benzimidazol-3-ium Openeye Name: 2-isobutyl-3-(p-tolylmethyl)-1H-benzimidazol-3-ium CAS Name: 3-[(4-methylphenyl)methyl]-2-(2-methylpropyl)-1H-benzimidazol-3-ium IUPAC Name: 3-[(4-methylphenyl)methyl]-2-(2-methylpropyl)-1H-benzimidazol-3-ium Traditional Name: 2-isobutyl-3-(4-methylbenzyl)-1H-benzimidazol-3-ium Formula: C19H23N2+ MolecularWeight: 279.39932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C[N+]2=C(NC3=CC=CC=C32)CC(C)C

InChI

InChI=1S/C19H22N2/c1-14(2)12-19-20-17-6-4-5-7-18(17)21(19)13-16-10-8-15(3)9-11-16/h4-11,14H,12-13H2,1-3H3/p+1