3,5-dimethyl-N-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-1-ium-3-yl]methyl]-1,2-oxazole-4-carboxamide

Systemtic Name: 3,5-dimethyl-N-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-1-ium-3-yl]methyl]-1,2-oxazole-4-carboxamide Openeye Name: 3,5-dimethyl-N-[[2-[methyl-[2-(2-pyridyl)ethyl]amino]pyridin-1-ium-3-yl]methyl]isoxazole-4-carboxamide CAS Name: 3,5-dimethyl-N-[[2-[methyl-[2-(2-pyridinyl)ethyl]amino]-3-pyridin-1-iumyl]methyl]-4-isoxazolecarboxamide IUPAC Name: 3,5-dimethyl-N-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-1-ium-3-yl]methyl]-1,2-oxazole-4-carboxamide Traditional Name: 3,5-dimethyl-N-[[2-[methyl-[2-(2-pyridyl)ethyl]amino]pyridin-1-ium-3-yl]methyl]isoxazole-4-carboxamide Formula: C20H24N5O2+ MolecularWeight: 366.43686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)NCC2=C([NH+]=CC=C2)N(C)CCC3=CC=CC=N3

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)NCC2=C([NH+]=CC=C2)N(C)CCC3=CC=CC=N3

InChI

InChI=1S/C20H23N5O2/c1-14-18(15(2)27-24-14)20(26)23-13-16-7-6-11-22-19(16)25(3)12-9-17-8-4-5-10-21-17/h4-8,10-11H,9,12-13H2,1-3H3,(H,23,26)/p+1