2-(1-ethylpiperidin-1-ium-4-yl)-N-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]ethanamide

Systemtic Name: 2-(1-ethylpiperidin-1-ium-4-yl)-N-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]ethanamide Openeye Name: 2-(1-ethylpiperidin-1-ium-4-yl)-N-[[2-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]methyl]acetamide CAS Name: 2-(1-ethyl-4-piperidin-1-iumyl)-N-[[2-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]methyl]acetamide IUPAC Name: 2-(1-ethylpiperidin-1-ium-4-yl)-N-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]acetamide Traditional Name: 2-(1-ethylpiperidin-1-ium-4-yl)-N-[[2-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]methyl]acetamide Formula: C20H35N5O+2 MolecularWeight: 361.5248

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)CC(=O)NCC2=C(N=CC=C2)N3CC[NH+](CC3)C

Isomeric SMILES

CC[NH+]1CCC(CC1)CC(=O)NCC2=C(N=CC=C2)N3CC[NH+](CC3)C

InChI

InChI=1S/C20H33N5O/c1-3-24-9-6-17(7-10-24)15-19(26)22-16-18-5-4-8-21-20(18)25-13-11-23(2)12-14-25/h4-5,8,17H,3,6-7,9-16H2,1-2H3,(H,22,26)/p+2