2-({[5-Carboxy-2-(²H₅)ethylpentyl]oxy}carbonyl)(²H₄)benzoic acid

More details:

• Systematic name

  2-({[5-Carboxy-2-(~2~H_5_)ethylpentyl]oxy}carbonyl)(~2~H_4_)benzoic acid

• SMILES

  C([2H])([2H])([2H])C([2H])([2H])C(CCCC(=O)O)COC(=O)C1=C([2H])C([2H])=C([2H])C([2H])=C1C(=O)O [2H]c1c(c(c(c(c1[2H])C(=O)O)C(=O)OCC(CCCC(=O)O)C([2H])([2H])C([2H])([2H])[2H])[2H])[2H]

• Std. InChi

  InChI=1S/C16H20O6/c1-2-11(6-5-9-14(17)18)10-22-16(21)13-8-4-3-7-12(13)15(19)20/h3-4,7-8,11H,2,5-6,9-10H2,1H3,(H,17,18)(H,19,20)/i1D3,2D2,3D,4D,7D,8D

• Std. InChIKey

  XFGRNAPKLGXDGF-QBTVFIPJSA-N

• Cite this record

  CSID:58785620, http://www.chemspider.com/Chemical-Structure.58785620.html (accessed 04:10, Apr 27, 2024)