ethyl-(furan-3-ylmethyl)-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]azanium

Systemtic Name: ethyl-(furan-3-ylmethyl)-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]azanium Openeye Name: ethyl-(3-furylmethyl)-[[1-[2-(o-tolyl)ethyl]piperidin-1-ium-4-yl]methyl]ammonium CAS Name: ethyl-(3-furanylmethyl)-[[1-[2-(2-methylphenyl)ethyl]-4-piperidin-1-iumyl]methyl]ammonium IUPAC Name: ethyl-(furan-3-ylmethyl)-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]azanium Traditional Name: ethyl-(3-furfuryl)-[[1-[2-(o-tolyl)ethyl]piperidin-1-ium-4-yl]methyl]ammonium Formula: C22H34N2O+2 MolecularWeight: 342.51816

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1CC[NH+](CC1)CCC2=CC=CC=C2C)CC3=COC=C3

Isomeric SMILES

CC[NH+](CC1CC[NH+](CC1)CCC2=CC=CC=C2C)CC3=COC=C3

InChI

InChI=1S/C22H32N2O/c1-3-23(17-21-11-15-25-18-21)16-20-8-12-24(13-9-20)14-10-22-7-5-4-6-19(22)2/h4-7,11,15,18,20H,3,8-10,12-14,16-17H2,1-2H3/p+2