2-fluoranyl-5-[[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]sulfamoyl]benzoic acid

Systemtic Name: 2-fluoranyl-5-[[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]sulfamoyl]benzoic acid Openeye Name: 2-fluoro-5-[[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]sulfamoyl]benzoic acid CAS Name: 2-fluoro-5-[[[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]sulfamoyl]benzoic acid IUPAC Name: 2-fluoro-5-[[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]sulfamoyl]benzoic acid Traditional Name: 2-fluoro-5-[[(3-pyrrolidinosulfonylbenzoyl)amino]sulfamoyl]benzoic acid Formula: C18H18FN3O7S2 MolecularWeight: 471.479823

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NNS(=O)(=O)C3=CC(=C(C=C3)F)C(=O)O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NNS(=O)(=O)C3=CC(=C(C=C3)F)C(=O)O

InChI

InChI=1S/C18H18FN3O7S2/c19-16-7-6-13(11-15(16)18(24)25)30(26,27)21-20-17(23)12-4-3-5-14(10-12)31(28,29)22-8-1-2-9-22/h3-7,10-11,21H,1-2,8-9H2,(H,20,23)(H,24,25)