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

  Molecular Weight	401.41257 [g/mol]
  Molecular Formula	C17H20N3NaO5S
  H-Bond Donor	3
  H-Bond Acceptor	6
  Rotatable Bond Count	5
  Tautomer Count	2
  Exact Mass	401.102136
  MonoIsotopic Mass	401.102136
  Topological Polar Surface Area	122
  Heavy Atom Count	27
  Formal Charge	0
  Complexity	587
  Isotope Atom Count	0
  Defined Atom StereoCenter Count	0
  Undefined Atom StereoCenter Count	4
  Defined Bond StereoCenter Count	0
  Undefined Bond StereoCenter Count	0
  Covalently-Bonded Unit Count	2

  
  [ Descriptors Computed from Structure]
  IUPAC Name: sodium
  6-[[2-(hydroxymethylamino)-2-phenylacetyl]amino]-3,
  3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
  Canonical SMILES: CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)NCO)C(=O)[O-])C.[Na+]
  InChI: InChI=1/C17H21N3O5S.Na/c1-17(2)12(16(24)25)20-14(23)11(15(20)26-17)19-13
  (22)10(18-8-21)9-6-4-3-5-7-9;/h3-7,10-12,15,18,21H,8H2,1-2H3,(H,19,
  22)(H,24,25);/q;+1/p-1/fC17H20N3O5S.Na/h19H;/q-1;m