[4-(furan-2-ylcarbonylamino)phenyl] 4-(dimethylsulfamoyl)-2-nitro-benzenesulfonate

Systemtic Name: [4-(furan-2-ylcarbonylamino)phenyl] 4-(dimethylsulfamoyl)-2-nitro-benzenesulfonate Openeye Name: [4-(furan-2-carbonylamino)phenyl] 4-(dimethylsulfamoyl)-2-nitro-benzenesulfonate CAS Name: 4-(dimethylsulfamoyl)-2-nitrobenzenesulfonic acid [4-[[2-furanyl(oxo)methyl]amino]phenyl] ester IUPAC Name: [4-(furan-2-carbonylamino)phenyl] 4-(dimethylsulfamoyl)-2-nitrobenzenesulfonate Traditional Name: 4-(dimethylsulfamoyl)-2-nitro-benzenesulfonic acid [4-(2-furoylamino)phenyl] ester Formula: C19H17N3O9S2 MolecularWeight: 495.48298

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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=C(C=C2)NC(=O)C3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O9S2/c1-21(2)32(26,27)15-9-10-18(16(12-15)22(24)25)33(28,29)31-14-7-5-13(6-8-14)20-19(23)17-4-3-11-30-17/h3-12H,1-2H3,(H,20,23)