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

Systemtic Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-2-(4-propanoylphenoxy)ethanamide Openeye Name: N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-2-(4-propanoylphenoxy)acetamide CAS Name: N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-2-[4-(1-oxopropyl)phenoxy]acetamide IUPAC Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-2-(4-propanoylphenoxy)acetamide Traditional Name: N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-2-(4-propionylphenoxy)acetamide Formula: C21H26N3O4+ MolecularWeight: 384.44884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O4/c1-2-19(25)17-4-6-18(7-5-17)28-15-21(26)23-14-16-3-8-20(22-13-16)24-9-11-27-12-10-24/h3-8,13H,2,9-12,14-15H2,1H3,(H,23,26)/p+1