5-bromanyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-2-oxidanyl-benzamide

Systemtic Name: 5-bromanyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-2-oxidanyl-benzamide Openeye Name: 5-bromo-2-hydroxy-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]benzamide CAS Name: 5-bromo-2-hydroxy-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]benzamide IUPAC Name: 5-bromo-2-hydroxy-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]benzamide Traditional Name: 5-bromo-2-hydroxy-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]benzamide Formula: C17H19BrN3O3+ MolecularWeight: 393.25506

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C3=C(C=CC(=C3)Br)O

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C3=C(C=CC(=C3)Br)O

InChI

InChI=1S/C17H18BrN3O3/c18-13-2-3-15(22)14(9-13)17(23)20-11-12-1-4-16(19-10-12)21-5-7-24-8-6-21/h1-4,9-10,22H,5-8,11H2,(H,20,23)/p+1