2-(2-ethyl-6-methyl-pyridin-3-yl)oxy-N-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]methyl]ethanamide

Systemtic Name: 2-(2-ethyl-6-methyl-pyridin-3-yl)oxy-N-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]methyl]ethanamide Openeye Name: 2-[(2-ethyl-6-methyl-3-pyridyl)oxy]-N-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]methyl]acetamide CAS Name: 2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-N-[[2-(4-methyl-1-piperazin-4-iumyl)-3-pyridin-1-iumyl]methyl]acetamide IUPAC Name: 2-(2-ethyl-6-methylpyridin-3-yl)oxy-N-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]methyl]acetamide Traditional Name: 2-[(2-ethyl-6-methyl-3-pyridyl)oxy]-N-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]methyl]acetamide Formula: C21H31N5O2+2 MolecularWeight: 385.50314

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=N1)C)OCC(=O)NCC2=C([NH+]=CC=C2)N3CC[NH+](CC3)C

Isomeric SMILES

CCC1=C(C=CC(=N1)C)OCC(=O)NCC2=C([NH+]=CC=C2)N3CC[NH+](CC3)C

InChI

InChI=1S/C21H29N5O2/c1-4-18-19(8-7-16(2)24-18)28-15-20(27)23-14-17-6-5-9-22-21(17)26-12-10-25(3)11-13-26/h5-9H,4,10-15H2,1-3H3,(H,23,27)/p+2