4-[[6-(dimethylamino)pyridin-1-ium-3-yl]amino]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[[6-(dimethylamino)pyridin-1-ium-3-yl]amino]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[[6-(dimethylamino)pyridin-1-ium-3-yl]amino]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[[6-(dimethylamino)-3-pyridin-1-iumyl]amino]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[[6-(dimethylamino)pyridin-1-ium-3-yl]amino]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[[6-(dimethylamino)pyridin-1-ium-3-yl]amino]-N-methyl-3-nitro-benzenesulfonamide Formula: C14H18N5O4S+ MolecularWeight: 352.38882

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)NC2=C[NH+]=C(C=C2)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)NC2=C[NH+]=C(C=C2)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H17N5O4S/c1-15-24(22,23)11-5-6-12(13(8-11)19(20)21)17-10-4-7-14(16-9-10)18(2)3/h4-9,15,17H,1-3H3/p+1