N,N-diethyl-3-nitro-4-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-nitro-4-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]benzenesulfonamide Openeye Name: N,N-diethyl-3-nitro-4-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]benzenesulfonamide CAS Name: N,N-diethyl-3-nitro-4-[(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)amino]benzenesulfonamide IUPAC Name: N,N-diethyl-3-nitro-4-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]benzenesulfonamide Traditional Name: N,N-diethyl-3-nitro-4-[(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amino]benzenesulfonamide Formula: C19H33N4O4S+ MolecularWeight: 413.55472

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NC2CC([NH2+]C(C2)(C)C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NC2CC([NH2+]C(C2)(C)C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H32N4O4S/c1-7-22(8-2)28(26,27)15-9-10-16(17(11-15)23(24)25)20-14-12-18(3,4)21-19(5,6)13-14/h9-11,14,20-21H,7-8,12-13H2,1-6H3/p+1