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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[N+]2=C(NC3=CC=CC=C32)CC(C)C

Isomeric SMILES

CC1=CC=CC=C1C[N+]2=C(NC3=CC=CC=C32)CC(C)C

InChI

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