1H-imidazol-5-ylmethyl-[[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]methyl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: 1H-imidazol-5-ylmethyl-[[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]methyl]-(pyridin-3-ylmethyl)azanium Openeye Name: 1H-imidazol-5-ylmethyl-[[1-(o-tolylmethyl)piperidin-1-ium-4-yl]methyl]-(3-pyridylmethyl)ammonium CAS Name: 1H-imidazol-5-ylmethyl-[[1-[(2-methylphenyl)methyl]-4-piperidin-1-iumyl]methyl]-(3-pyridinylmethyl)ammonium IUPAC Name: 1H-imidazol-5-ylmethyl-[[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]methyl]-(pyridin-3-ylmethyl)azanium Traditional Name: 1H-imidazol-5-ylmethyl-[[1-(2-methylbenzyl)piperidin-1-ium-4-yl]methyl]-(3-pyridylmethyl)ammonium Formula: C24H33N5+2 MolecularWeight: 391.55232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCC(CC2)C[NH+](CC3=CN=CC=C3)CC4=CN=CN4

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCC(CC2)C[NH+](CC3=CN=CC=C3)CC4=CN=CN4

InChI

InChI=1S/C24H31N5/c1-20-5-2-3-7-23(20)17-28-11-8-21(9-12-28)15-29(18-24-14-26-19-27-24)16-22-6-4-10-25-13-22/h2-7,10,13-14,19,21H,8-9,11-12,15-18H2,1H3,(H,26,27)/p+2