2-piperidin-1-ium-1-yl-N-[[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-1-ium-3-yl]methyl]ethanamide

Systemtic Name: 2-piperidin-1-ium-1-yl-N-[[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-1-ium-3-yl]methyl]ethanamide Openeye Name: 2-piperidin-1-ium-1-yl-N-[[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-1-ium-3-yl]methyl]acetamide CAS Name: 2-(1-piperidin-1-iumyl)-N-[[2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-3-pyridin-1-iumyl]methyl]acetamide IUPAC Name: 2-piperidin-1-ium-1-yl-N-[[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-1-ium-3-yl]methyl]acetamide Traditional Name: 2-piperidin-1-ium-1-yl-N-[[2-(4-pyridin-1-ium-2-ylpiperazino)pyridin-1-ium-3-yl]methyl]acetamide Formula: C22H33N6O+3 MolecularWeight: 397.53702

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NCC2=C([NH+]=CC=C2)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NCC2=C([NH+]=CC=C2)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C22H30N6O/c29-21(18-26-11-4-1-5-12-26)25-17-19-7-6-10-24-22(19)28-15-13-27(14-16-28)20-8-2-3-9-23-20/h2-3,6-10H,1,4-5,11-18H2,(H,25,29)/p+3