2,2-dimethyl-N-[[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-1-ium-3-yl]methyl]propanamide

Systemtic Name: 2,2-dimethyl-N-[[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-1-ium-3-yl]methyl]propanamide Openeye Name: 2,2-dimethyl-N-[[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-1-ium-3-yl]methyl]propanamide CAS Name: 2,2-dimethyl-N-[[2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-3-pyridin-1-iumyl]methyl]propanamide IUPAC Name: 2,2-dimethyl-N-[[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pyridin-1-ium-3-yl]methyl]propanamide Traditional Name: 2,2-dimethyl-N-[[2-(4-pyridin-1-ium-2-ylpiperazino)pyridin-1-ium-3-yl]methyl]propionamide Formula: C20H29N5O+2 MolecularWeight: 355.47716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NCC1=C([NH+]=CC=C1)N2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

CC(C)(C)C(=O)NCC1=C([NH+]=CC=C1)N2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C20H27N5O/c1-20(2,3)19(26)23-15-16-7-6-10-22-18(16)25-13-11-24(12-14-25)17-8-4-5-9-21-17/h4-10H,11-15H2,1-3H3,(H,23,26)/p+2