(1-ethylpiperidin-4-yl)-[[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-3-yl]methyl]azanium

Systemtic Name: (1-ethylpiperidin-4-yl)-[[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-3-yl]methyl]azanium Openeye Name: (1-ethyl-4-piperidyl)-[[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-3-pyridyl]methyl]ammonium CAS Name: (1-ethyl-4-piperidinyl)-[[2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-3-pyridinyl]methyl]ammonium IUPAC Name: (1-ethylpiperidin-4-yl)-[[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-3-yl]methyl]azanium Traditional Name: (1-ethyl-4-piperidyl)-[[2-(4-pyridin-1-ium-2-ylpiperazino)-3-pyridyl]methyl]ammonium Formula: C22H34N6+2 MolecularWeight: 382.54556

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)[NH2+]CC2=C(N=CC=C2)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

CCN1CCC(CC1)[NH2+]CC2=C(N=CC=C2)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C22H32N6/c1-2-26-12-8-20(9-13-26)25-18-19-6-5-11-24-22(19)28-16-14-27(15-17-28)21-7-3-4-10-23-21/h3-7,10-11,20,25H,2,8-9,12-18H2,1H3/p+2