1-[(4-methylphenyl)methyl]-2-(piperidin-1-ium-1-ylmethyl)benzimidazole

Systemtic Name: 1-[(4-methylphenyl)methyl]-2-(piperidin-1-ium-1-ylmethyl)benzimidazole Openeye Name: 2-(piperidin-1-ium-1-ylmethyl)-1-(p-tolylmethyl)benzimidazole CAS Name: 1-[(4-methylphenyl)methyl]-2-(1-piperidin-1-iumylmethyl)benzimidazole IUPAC Name: 1-[(4-methylphenyl)methyl]-2-(piperidin-1-ium-1-ylmethyl)benzimidazole Traditional Name: 1-(4-methylbenzyl)-2-(piperidin-1-ium-1-ylmethyl)benzimidazole Formula: C21H26N3+ MolecularWeight: 320.45124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2C[NH+]4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2C[NH+]4CCCCC4

InChI

InChI=1S/C21H25N3/c1-17-9-11-18(12-10-17)15-24-20-8-4-3-7-19(20)22-21(24)16-23-13-5-2-6-14-23/h3-4,7-12H,2,5-6,13-16H2,1H3/p+1