(5-fluoranyl-2-nitro-phenyl) 4-sulfamoylbenzenesulfonate

Systemtic Name: (5-fluoranyl-2-nitro-phenyl) 4-sulfamoylbenzenesulfonate Openeye Name: (5-fluoro-2-nitro-phenyl) 4-sulfamoylbenzenesulfonate CAS Name: 4-sulfamoylbenzenesulfonic acid (5-fluoro-2-nitrophenyl) ester IUPAC Name: (5-fluoro-2-nitrophenyl) 4-sulfamoylbenzenesulfonate Traditional Name: 4-sulfamoylbenzenesulfonic acid (5-fluoro-2-nitro-phenyl) ester Formula: C12H9FN2O7S2 MolecularWeight: 376.337463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)(=O)N)S(=O)(=O)OC2=C(C=CC(=C2)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1S(=O)(=O)N)S(=O)(=O)OC2=C(C=CC(=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C12H9FN2O7S2/c13-8-1-6-11(15(16)17)12(7-8)22-24(20,21)10-4-2-9(3-5-10)23(14,18)19/h1-7H,(H2,14,18,19)