5-(Phenylmethyl) (2S)-2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)pentanedioate

CAS Registry Number®

88784-33-2

CAS Name

5-(Phenylmethyl) (2S)-2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)pentanedioate

Molecular Formula

C20H17NO6

Molecular Mass

367.35

Cite this Page

5-(Phenylmethyl) (2S)-2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)pentanedioate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=88784-33-2 (retrieved 2024-11-22) (CAS RN: 88784-33-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    135-136 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H17NO6/c22-17(27-12-13-6-2-1-3-7-13)11-10-16(20(25)26)21-18(23)14-8-4-5-9-15(14)19(21)24/h1-9,16H,10-12H2,(H,25,26)/t16-/m0/s1

InChIKey

InChIKey=MQUZTINHMZQECR-INIZCTEOSA-N

SMILES

[C@H](CCC(OCC1=CC=CC=C1)=O)(C(O)=O)N2C(=O)C=3C(C2=O)=CC=CC3

Canonical SMILES

O=C(O)C(N1C(=O)C=2C=CC=CC2C1=O)CCC(=O)OCC=3C=CC=CC3

Other Names for this Substance

  • Pentanedioic acid, 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-, 5-(phenylmethyl) ester, (2S)-
  • Pentanedioic acid, 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-, 5-(phenylmethyl) ester, (S)-
  • 5-(Phenylmethyl) (2S)-2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)pentanedioate
  • (S)-2-(1,3-Dioxo-1,3-dihydroisoindol-2-yl)pentanedioic acid 5-benzyl ester
  • (S)-5-(Benzyloxy)-2-(1,3-dioxoisoindolin-2-yl)-5-oxopentanoic acid

CAS INSIGHTSTM
Targeted protein degrader structure, illustration