2,3-diethyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]quinoxaline-6-carboxamide

Systemtic Name: 2,3-diethyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]quinoxaline-6-carboxamide Openeye Name: 2,3-diethyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]quinoxaline-6-carboxamide CAS Name: 2,3-diethyl-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-6-quinoxalinecarboxamide IUPAC Name: 2,3-diethyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]quinoxaline-6-carboxamide Traditional Name: 2,3-diethyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]quinoxaline-6-carboxamide Formula: C23H28N5O2+ MolecularWeight: 406.50072

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C(C=C2)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4)N=C1CC

Isomeric SMILES

CCC1=NC2=C(C=C(C=C2)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4)N=C1CC

InChI

InChI=1S/C23H27N5O2/c1-3-18-19(4-2)27-21-13-17(6-7-20(21)26-18)23(29)25-15-16-5-8-22(24-14-16)28-9-11-30-12-10-28/h5-8,13-14H,3-4,9-12,15H2,1-2H3,(H,25,29)/p+1