1H-Isoindole-1,3(2H)-dione, 2-(3R)-3-piperidinyl-, (2S,3S)-2,3-dihydroxybutanedioate (1:1)

CAS Registry Number®

886588-62-1
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CAS Name

1H-Isoindole-1,3(2H)-dione, 2-(3R)-3-piperidinyl-, (2S,3S)-2,3-dihydroxybutanedioate (1:1)

Molecular Formula

C13H14N2O2.C4H6O6

Cite this Page

1H-Isoindole-1,3(2H)-dione, 2-(3R)-3-piperidinyl-, (2S,3S)-2,3-dihydroxybutanedioate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=886588-62-1 (retrieved 2024-07-03) (CAS RN: 886588-62-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H14N2O2.C4H6O6/c16-12-10-5-1-2-6-11(10)13(17)15(12)9-4-3-7-14-8-9;5-1(3(7)8)2(6)4(9)10/h1-2,5-6,9,14H,3-4,7-8H2;1-2,5-6H,(H,7,8)(H,9,10)/t9-;1-,2-/m10/s1

InChIKey

InChIKey=NLKBDTIEQFGGKV-VXLLBCKSSA-N

SMILES

O=C1N(C(=O)C=2C1=CC=CC2)[C@@H]3CCCNC3.[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=C1C=2C=CC=CC2C(=O)N1C3CNCCC3

Other Names for this Substance

  • 1H-Isoindole-1,3(2H)-dione, 2-(3R)-3-piperidinyl-, (2S,3S)-2,3-dihydroxybutanedioate (1:1)

Deleted or Replaced CAS Registry Numbers

1363531-10-5