• 
  [Synonyms]
  NSC669692
  [Structure]
  
  
  
  [ Properties Computed from Structure]
  

  Molecular Weight	303.269781 [g/mol]
  Molecular Formula	C8H18NO7PS
  H-Bond Donor	3
  H-Bond Acceptor	8
  Rotatable Bond Count	7
  Exact Mass	303.054159
  MonoIsotopic Mass	303.054159
  Topological Polar Surface Area	136
  Heavy Atom Count	18
  Formal Charge	0
  Complexity	230
  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	2

  
  [ Descriptors Computed from Structure]
  IUPAC Name: 1-dimethoxyphosphoryl-3-methylsulfanylpropan-1-amine; oxalic acid
  Canonical SMILES: COP(=O)(C(CCSC)N)OC.C(=O)(C(=O)O)O
  InChI: InChI=1/C6H16NO3PS.C2H2O4/c1-9-11(8,10-2)6(7)4-5-12-3;3-1(4)2(5)6/h6H,
  4-5,7H2,1-3H3;(H,3,4)(H,5,6)/f/h;3,5H