4-bromanyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]benzenesulfonamide Openeye Name: 4-bromo-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]benzenesulfonamide CAS Name: 4-bromo-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]benzenesulfonamide Traditional Name: 4-bromo-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]benzenesulfonamide Formula: C16H19BrN3O3S+ MolecularWeight: 413.30936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18BrN3O3S/c17-14-2-4-15(5-3-14)24(21,22)19-12-13-1-6-16(18-11-13)20-7-9-23-10-8-20/h1-6,11,19H,7-10,12H2/p+1