N-tert-butyl-3-nitro-4-(2-sulfamoylethylamino)benzenesulfonamide

Systemtic Name: N-tert-butyl-3-nitro-4-(2-sulfamoylethylamino)benzenesulfonamide Openeye Name: N-tert-butyl-3-nitro-4-(2-sulfamoylethylamino)benzenesulfonamide CAS Name: N-tert-butyl-3-nitro-4-(2-sulfamoylethylamino)benzenesulfonamide IUPAC Name: N-tert-butyl-3-nitro-4-(2-sulfamoylethylamino)benzenesulfonamide Traditional Name: N-tert-butyl-3-nitro-4-(2-sulfamoylethylamino)benzenesulfonamide Formula: C12H20N4O6S2 MolecularWeight: 380.4404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20N4O6S2/c1-12(2,3)15-24(21,22)9-4-5-10(11(8-9)16(17)18)14-6-7-23(13,19)20/h4-5,8,14-15H,6-7H2,1-3H3,(H2,13,19,20)