2-[[5-(diethylsulfamoyl)-2-fluoranyl-phenyl]carbonylamino]terephthalic acid

Systemtic Name: 2-[[5-(diethylsulfamoyl)-2-fluoranyl-phenyl]carbonylamino]terephthalic acid Openeye Name: 2-[[5-(diethylsulfamoyl)-2-fluoro-benzoyl]amino]terephthalic acid CAS Name: 2-[[[5-(diethylsulfamoyl)-2-fluorophenyl]-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[[5-(diethylsulfamoyl)-2-fluorobenzoyl]amino]terephthalic acid Traditional Name: 2-[[5-(diethylsulfamoyl)-2-fluoro-benzoyl]amino]terephthalic acid Formula: C19H19FN2O7S MolecularWeight: 438.426763

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C19H19FN2O7S/c1-3-22(4-2)30(28,29)12-6-8-15(20)14(10-12)17(23)21-16-9-11(18(24)25)5-7-13(16)19(26)27/h5-10H,3-4H2,1-2H3,(H,21,23)(H,24,25)(H,26,27)