1-Azabicyclo[2.2.2]octan-3-ol, acetate (ester), (3R)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) (salt)

CAS Registry Number®

139729-83-2

CAS Name

1-Azabicyclo[2.2.2]octan-3-ol, acetate (ester), (3R)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) (salt)

Molecular Formula

C9H15NO2.C4H6O6

Cite this Page

1-Azabicyclo[2.2.2]octan-3-ol, acetate (ester), (3R)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) (salt).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=139729-83-2 (retrieved 2024-12-22) (CAS RN: 139729-83-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H15NO2.C4H6O6/c1-7(11)12-9-6-10-4-2-8(9)3-5-10;5-1(3(7)8)2(6)4(9)10/h8-9H,2-6H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t9-;1-,2-/m01/s1

InChIKey

InChIKey=NEBPFCSYXMUAEN-NDAAPVSOSA-N

SMILES

O(C(C)=O)[C@@H]1C2(CCN(C1)CC2)[H].[C@@H]([C@H](C(O)=O)O)(C(O)=O)O

Canonical SMILES

O=C(O)C(O)C(O)C(=O)O.O=C(OC1CN2CCC1CC2)C

Other Names for this Substance

  • 1-Azabicyclo[2.2.2]octan-3-ol, acetate (ester), (3R)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) (salt)
  • 1-Azabicyclo[2.2.2]octan-3-ol, acetate (ester), (R)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) (salt)
  • 1-Azabicyclo[2.2.2]octan-3-ol, acetate (ester), (R)-, [R-(R*,R*)]-2,3-dihydroxybutanedioate (1:1) (salt)

Deleted or Replaced CAS Registry Numbers

2192289-57-7

CAS INSIGHTSTM
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