3-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]propylazanium

Systemtic Name: 3-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]propylazanium Openeye Name: 3-[1-(o-tolylmethyl)benzimidazol-2-yl]propylammonium CAS Name: 3-[1-[(2-methylphenyl)methyl]-2-benzimidazolyl]propylammonium IUPAC Name: 3-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]propylazanium Traditional Name: 3-[1-(2-methylbenzyl)benzimidazol-2-yl]propylammonium Formula: C18H22N3+ MolecularWeight: 280.38738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C3=CC=CC=C3N=C2CCC[NH3+]

Isomeric SMILES

CC1=CC=CC=C1CN2C3=CC=CC=C3N=C2CCC[NH3+]

InChI

InChI=1S/C18H21N3/c1-14-7-2-3-8-15(14)13-21-17-10-5-4-9-16(17)20-18(21)11-6-12-19/h2-5,7-10H,6,11-13,19H2,1H3/p+1