2-(4-ethanoyl-2-methoxy-phenoxy)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]ethanamide

Systemtic Name: 2-(4-ethanoyl-2-methoxy-phenoxy)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]ethanamide Openeye Name: 2-(4-acetyl-2-methoxy-phenoxy)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]acetamide CAS Name: 2-(4-acetyl-2-methoxyphenoxy)-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]acetamide IUPAC Name: 2-(4-acetyl-2-methoxyphenoxy)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]acetamide Traditional Name: 2-(4-acetyl-2-methoxy-phenoxy)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]acetamide Formula: C21H26N3O5+ MolecularWeight: 400.44824

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCC(=O)NCC2=C[NH+]=C(C=C2)N3CCOCC3)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCC(=O)NCC2=C[NH+]=C(C=C2)N3CCOCC3)OC

InChI

InChI=1S/C21H25N3O5/c1-15(25)17-4-5-18(19(11-17)27-2)29-14-21(26)23-13-16-3-6-20(22-12-16)24-7-9-28-10-8-24/h3-6,11-12H,7-10,13-14H2,1-2H3,(H,23,26)/p+1