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

Systemtic Name: (2-cyanophenyl) 4-(dimethylsulfamoyl)-2-nitro-benzenesulfonate Openeye Name: (2-cyanophenyl) 4-(dimethylsulfamoyl)-2-nitro-benzenesulfonate CAS Name: 4-(dimethylsulfamoyl)-2-nitrobenzenesulfonic acid (2-cyanophenyl) ester IUPAC Name: (2-cyanophenyl) 4-(dimethylsulfamoyl)-2-nitrobenzenesulfonate Traditional Name: 4-(dimethylsulfamoyl)-2-nitro-benzenesulfonic acid (2-cyanophenyl) ester Formula: C15H13N3O7S2 MolecularWeight: 411.40962

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C#N)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C#N)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O7S2/c1-17(2)26(21,22)12-7-8-15(13(9-12)18(19)20)27(23,24)25-14-6-4-3-5-11(14)10-16/h3-9H,1-2H3