Ibuprofen lysine

CAS Registry Number®

57469-77-9

CAS Name

Ibuprofen lysine

Molecular Formula

C13H18O2.C6H14N2O2

Cite this Page

Ibuprofen lysine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=57469-77-9 (retrieved 2024-11-22) (CAS RN: 57469-77-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H18O2.C6H14N2O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15;7-4-2-1-3-5(8)6(9)10/h4-7,9-10H,8H2,1-3H3,(H,14,15);5H,1-4,7-8H2,(H,9,10)/t;5-/m.0/s1

InChIKey

InChIKey=IHHXIUAEPKVVII-ZSCHJXSPSA-N

SMILES

C(C(O)=O)(C)C1=CC=C(CC(C)C)C=C1.[C@H](CCCCN)(C(O)=O)N

Canonical SMILES

O=C(O)C(N)CCCCN.O=C(O)C(C1=CC=C(C=C1)CC(C)C)C

Other Names for this Substance

  • L-Lysine, α-methyl-4-(2-methylpropyl)benzeneacetate (1:1)
  • L-Lysine, mono[α-methyl-4-(2-methylpropyl)benzeneacetate]
  • Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, compd. with L-lysine (1:1)
  • Lysine 2-(p-isobutylphenyl)propionate
  • Solufenum

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Deleted or Replaced CAS Registry Numbers

127701-63-7, 82240-06-0

CAS INSIGHTSTM
Targeted protein degrader structure, illustration