2-{[3-Chloro-2-(²H₃)methyl(²H₃)phenyl]amino}nicotinic acid - L-lysine (1:1)

More details:

• Systematic name

  2-{[3-Chloro-2-(~2~H_3_)methyl(~2~H_3_)phenyl]amino}nicotinic acid - L-lysine (1:1)

• SMILES

  [2H]C1=C([2H])C(Cl)=C(C(NC2=NC=CC=C2C(O)=O)=C1[2H])C([2H])([2H])[2H].NCCCC[C@H](N)C(O)=O

• Std. InChi

  InChI=1S/C13H11ClN2O2.C6H14N2O2/c1-8-10(14)5-2-6-11(8)16-12-9(13(17)18)4-3-7-15-12;7-4-2-1-3-5(8)6(9)10/h2-7H,1H3,(H,15,16)(H,17,18);5H,1-4,7-8H2,(H,9,10)/t;5-/m.0/s1/i1D3,2D,5D,6D;

• Std. InChIKey

  CVNFYQCHAWFYQI-DKIOCXPBSA-N

• Cite this record

  CSID:107449014, http://www.chemspider.com/Chemical-Structure.107449014.html (accessed 01:20, Jun 1, 2024)