• 
  [Synonyms]
  CBMicro_014114
  ChemDiv2_001220
  STOCK3S-52960
  NSC66425
  N-(4-Sulfamoyl-phenyl)-phthalamic acid
  BAS 00546793
  BIM-0014331.P001
  EU-0081946
  6955-49-3
  
  [Structure]
  
  
  
  [ Properties Computed from Structure]
  

  Molecular Weight	320.32048 [g/mol]
  Molecular Formula	C14H12N2O5S
  XLogP	1.1
  H-Bond Donor	3
  H-Bond Acceptor	6
  Rotatable Bond Count	4
  Tautomer Count	2
  Exact Mass	320.046692
  MonoIsotopic Mass	320.046692
  Topological Polar Surface Area	127
  Heavy Atom Count	22
  Formal Charge	0
  Complexity	520
  Isotope Atom Count	0
  Defined Atom StereoCenter Count	0
  Undefined Atom StereoCenter Count	0
  Defined Bond StereoCenter Count	0
  Undefined Bond StereoCenter Count	0
  Covalently-Bonded Unit Count	1

  
  [ Descriptors Computed from Structure]
  IUPAC Name: 2-[(4-sulfamoylphenyl)carbamoyl]benzoic acid
  Canonical SMILES: C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)C(=O)O
  InChI: InChI=1/C14H12N2O5S/c15-22(20,
  21)10-7-5-9(6-8-10)16-13(17)11-3-1-2-4-12(11)14(18)19/h1-8H,(H,16,17)(H,
  18,19)(H2,15,20,21)/f/h16,18H,15H2