N-(2,6-dimethylpiperidin-1-ium-1-yl)-4-nitro-benzenesulfonamide chloride

Systemtic Name: N-(2,6-dimethylpiperidin-1-ium-1-yl)-4-nitro-benzenesulfonamide chloride Openeye Name: N-(2,6-dimethylpiperidin-1-ium-1-yl)-4-nitro-benzenesulfonamide chloride CAS Name: N-(2,6-dimethyl-1-piperidin-1-iumyl)-4-nitrobenzenesulfonamide chloride IUPAC Name: N-(2,6-dimethylpiperidin-1-ium-1-yl)-4-nitrobenzenesulfonamide chloride Traditional Name: N-(2,6-dimethylpiperidin-1-ium-1-yl)-4-nitro-benzenesulfonamide chloride Formula: C13H20ClN3O4S MolecularWeight: 349.8336

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([NH+]1NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C.[Cl-]

Isomeric SMILES

CC1CCCC([NH+]1NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C.[Cl-]

InChI

InChI=1S/C13H19N3O4S.ClH/c1-10-4-3-5-11(2)15(10)14-21(19,20)13-8-6-12(7-9-13)16(17)18;/h6-11,14H,3-5H2,1-2H3;1H