D-Glucitol, 1-deoxy-1-(methylamino)-, α-methyl-4-(2-methylpropyl)benzeneacetate (1:1)

CAS Registry Number®

135861-34-6

CAS Name

D-Glucitol, 1-deoxy-1-(methylamino)-, α-methyl-4-(2-methylpropyl)benzeneacetate (1:1)

Molecular Formula

C13H18O2.C7H17NO5

Cite this Page

D-Glucitol, 1-deoxy-1-(methylamino)-, α-methyl-4-(2-methylpropyl)benzeneacetate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=135861-34-6 (retrieved 2024-11-22) (CAS RN: 135861-34-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H18O2.C7H17NO5/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15;1-8-2-4(10)6(12)7(13)5(11)3-9/h4-7,9-10H,8H2,1-3H3,(H,14,15);4-13H,2-3H2,1H3/t;4-,5+,6+,7+/m.0/s1

InChIKey

InChIKey=VXVMMZWKWPUJIT-WZTVWXICSA-N

SMILES

C(C(O)=O)(C)C1=CC=C(CC(C)C)C=C1.[C@H]([C@@H]([C@@H](CO)O)O)([C@H](CNC)O)O

Canonical SMILES

O=C(O)C(C1=CC=C(C=C1)CC(C)C)C.OCC(O)C(O)C(O)C(O)CNC

Other Names for this Substance

  • D-Glucitol, 1-deoxy-1-(methylamino)-, α-methyl-4-(2-methylpropyl)benzeneacetate (1:1)
  • D-Glucitol, 1-deoxy-1-(methylamino)-, α-methyl-4-(2-methylpropyl)benzeneacetate (salt)
  • Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, compd. with 1-deoxy-1-(methylamino)-D-glucitol (1:1)
  • Artrene
  • Ibuprofen methylglucamine salt

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