(2-acetamidophenyl) 4-(dimethylsulfamoyl)-2-nitro-benzenesulfonate

Systemtic Name: (2-acetamidophenyl) 4-(dimethylsulfamoyl)-2-nitro-benzenesulfonate Openeye Name: (2-acetamidophenyl) 4-(dimethylsulfamoyl)-2-nitro-benzenesulfonate CAS Name: 4-(dimethylsulfamoyl)-2-nitrobenzenesulfonic acid (2-acetamidophenyl) ester IUPAC Name: (2-acetamidophenyl) 4-(dimethylsulfamoyl)-2-nitrobenzenesulfonate Traditional Name: 4-(dimethylsulfamoyl)-2-nitro-benzenesulfonic acid (2-acetamidophenyl) ester Formula: C16H17N3O8S2 MolecularWeight: 443.45148

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1OS(=O)(=O)C2=C(C=C(C=C2)S(=O)(=O)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=CC=C1OS(=O)(=O)C2=C(C=C(C=C2)S(=O)(=O)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O8S2/c1-11(20)17-13-6-4-5-7-15(13)27-29(25,26)16-9-8-12(10-14(16)19(21)22)28(23,24)18(2)3/h4-10H,1-3H3,(H,17,20)