• 
  [Synonyms]
  NSC644787
  AIDS138290
  AIDS-138290
  NCI60_015198
  N-(2,5-Dichlorophenyl)-3-(hydroxy(oxido)amino)-2-oxo-3-(2-quinoxalinyl)propanamide
  
  [Structure]
  
  
  
  [ Properties Computed from Structure]
  

  Molecular Weight	405.1917 [g/mol]
  Molecular Formula	C17H10Cl2N4O4
  XLogP	4.2
  H-Bond Donor	1
  H-Bond Acceptor	6
  Rotatable Bond Count	4
  Tautomer Count	8
  Exact Mass	404.00791
  MonoIsotopic Mass	404.00791
  Topological Polar Surface Area	115
  Heavy Atom Count	27
  Formal Charge	0
  Complexity	588
  Isotope Atom Count	0
  Defined Atom StereoCenter Count	0
  Undefined Atom StereoCenter Count	1
  Defined Bond StereoCenter Count	0
  Undefined Bond StereoCenter Count	0
  Covalently-Bonded Unit Count	1

  
  [ Descriptors Computed from Structure]
  IUPAC Name: N-(2,5-dichlorophenyl)-3-nitro-2-oxo-3-quinoxalin-2-ylpropanamide
  Canonical SMILES: C1=CC=C2C(=C1)N=CC(=N2)C(C(=O)C(=O)NC3=C(C=CC(=C3)Cl)Cl)[N+](=O)[O-]
  InChI: InChI=1/C17H10Cl2N4O4/c18-9-5-6-10(19)13(7-9)22-17(25)16(24)15(23(26)27)
  14-8-20-11-3-1-2-4-12(11)21-14/h1-8,15H,(H,22,25)/f/h22H