3,4,5-trimethoxy-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]benzamide CAS Name: 3,4,5-trimethoxy-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]benzamide Traditional Name: 3,4,5-trimethoxy-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]benzamide Formula: C20H26N3O5+ MolecularWeight: 388.43754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NCC2=C[NH+]=C(C=C2)N3CCOCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NCC2=C[NH+]=C(C=C2)N3CCOCC3

InChI

InChI=1S/C20H25N3O5/c1-25-16-10-15(11-17(26-2)19(16)27-3)20(24)22-13-14-4-5-18(21-12-14)23-6-8-28-9-7-23/h4-5,10-12H,6-9,13H2,1-3H3,(H,22,24)/p+1