N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]benzenesulfonamide

Systemtic Name: N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]benzenesulfonamide Openeye Name: N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]benzenesulfonamide CAS Name: N-[[2-(dimethylamino)-3-pyridin-1-iumyl]methyl]benzenesulfonamide IUPAC Name: N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]benzenesulfonamide Traditional Name: N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]benzenesulfonamide Formula: C14H18N3O2S+ MolecularWeight: 292.37662

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=CC=[NH+]1)CNS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CN(C)C1=C(C=CC=[NH+]1)CNS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H17N3O2S/c1-17(2)14-12(7-6-10-15-14)11-16-20(18,19)13-8-4-3-5-9-13/h3-10,16H,11H2,1-2H3/p+1