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

Systemtic Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-2-(4-phenylmethoxyphenoxy)ethanamide Openeye Name: 2-(4-benzyloxyphenoxy)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]acetamide CAS Name: N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-2-(4-phenylmethoxyphenoxy)acetamide IUPAC Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-2-(4-phenylmethoxyphenoxy)acetamide Traditional Name: 2-(4-benzoxyphenoxy)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]acetamide Formula: C25H28N3O4+ MolecularWeight: 434.50752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)COC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)COC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H27N3O4/c29-25(27-17-21-6-11-24(26-16-21)28-12-14-30-15-13-28)19-32-23-9-7-22(8-10-23)31-18-20-4-2-1-3-5-20/h1-11,16H,12-15,17-19H2,(H,27,29)/p+1