ethyl-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-(pyridin-2-ylmethyl)azanium

Systemtic Name: ethyl-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-(pyridin-2-ylmethyl)azanium Openeye Name: ethyl-[[1-[2-(o-tolyl)ethyl]piperidin-1-ium-4-yl]methyl]-(2-pyridylmethyl)ammonium CAS Name: ethyl-[[1-[2-(2-methylphenyl)ethyl]-4-piperidin-1-iumyl]methyl]-(2-pyridinylmethyl)ammonium IUPAC Name: ethyl-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-(pyridin-2-ylmethyl)azanium Traditional Name: ethyl-[[1-[2-(o-tolyl)ethyl]piperidin-1-ium-4-yl]methyl]-(2-pyridylmethyl)ammonium Formula: C23H35N3+2 MolecularWeight: 353.5441

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1CC[NH+](CC1)CCC2=CC=CC=C2C)CC3=CC=CC=N3

Isomeric SMILES

CC[NH+](CC1CC[NH+](CC1)CCC2=CC=CC=C2C)CC3=CC=CC=N3

InChI

InChI=1S/C23H33N3/c1-3-25(19-23-10-6-7-14-24-23)18-21-11-15-26(16-12-21)17-13-22-9-5-4-8-20(22)2/h4-10,14,21H,3,11-13,15-19H2,1-2H3/p+2