N-tert-butyl-3-nitro-4-(1-oxidanidylpyridin-1-ium-2-yl)oxy-benzenesulfonamide

Systemtic Name: N-tert-butyl-3-nitro-4-(1-oxidanidylpyridin-1-ium-2-yl)oxy-benzenesulfonamide Openeye Name: N-tert-butyl-3-nitro-4-(1-oxidopyridin-1-ium-2-yl)oxy-benzenesulfonamide CAS Name: N-tert-butyl-3-nitro-4-[(1-oxido-2-pyridin-1-iumyl)oxy]benzenesulfonamide IUPAC Name: N-tert-butyl-3-nitro-4-(1-oxidopyridin-1-ium-2-yl)oxybenzenesulfonamide Traditional Name: N-tert-butyl-3-nitro-4-(1-oxidopyridin-1-ium-2-yl)oxy-benzenesulfonamide Formula: C15H17N3O6S MolecularWeight: 367.37698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)OC2=CC=CC=[N+]2[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)OC2=CC=CC=[N+]2[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O6S/c1-15(2,3)16-25(22,23)11-7-8-13(12(10-11)18(20)21)24-14-6-4-5-9-17(14)19/h4-10,16H,1-3H3