5-[5,6-dimethyl-1-[(2-methylphenyl)methyl]benzimidazol-2-yl]pentylazanium

Systemtic Name: 5-[5,6-dimethyl-1-[(2-methylphenyl)methyl]benzimidazol-2-yl]pentylazanium Openeye Name: 5-[5,6-dimethyl-1-(o-tolylmethyl)benzimidazol-2-yl]pentylammonium CAS Name: 5-[5,6-dimethyl-1-[(2-methylphenyl)methyl]-2-benzimidazolyl]pentylammonium IUPAC Name: 5-[5,6-dimethyl-1-[(2-methylphenyl)methyl]benzimidazol-2-yl]pentylazanium Traditional Name: 5-[5,6-dimethyl-1-(2-methylbenzyl)benzimidazol-2-yl]pentylammonium Formula: C22H30N3+ MolecularWeight: 336.4937

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C3=C(C=C(C(=C3)C)C)N=C2CCCCC[NH3+]

Isomeric SMILES

CC1=CC=CC=C1CN2C3=C(C=C(C(=C3)C)C)N=C2CCCCC[NH3+]

InChI

InChI=1S/C22H29N3/c1-16-9-6-7-10-19(16)15-25-21-14-18(3)17(2)13-20(21)24-22(25)11-5-4-8-12-23/h6-7,9-10,13-14H,4-5,8,11-12,15,23H2,1-3H3/p+1