Benzeneacetic acid, 3-benzoyl-α-methyl-, compd. with 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1), (αS)-

CAS Registry Number®

156604-79-4

CAS Name

Benzeneacetic acid, 3-benzoyl-α-methyl-, compd. with 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1), (αS)-

Molecular Formula

C16H14O3.C4H11NO3

Cite this Page

Benzeneacetic acid, 3-benzoyl-α-methyl-, compd. with 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1), (αS)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=156604-79-4 (retrieved 2024-11-22) (CAS RN: 156604-79-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H14O3.C4H11NO3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12;5-4(1-6,2-7)3-8/h2-11H,1H3,(H,18,19);6-8H,1-3,5H2/t11-;/m0./s1

InChIKey

InChIKey=QUZMDHVOUNDEKW-MERQFXBCSA-N

SMILES

C(=O)(C1=CC([C@@H](C(O)=O)C)=CC=C1)C2=CC=CC=C2.C(CO)(CO)(CO)N

Canonical SMILES

O=C(O)C(C=1C=CC=C(C1)C(=O)C=2C=CC=CC2)C.OCC(N)(CO)CO

Other Names for this Substance

  • Benzeneacetic acid, 3-benzoyl-α-methyl-, compd. with 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1), (αS)-
  • Benzeneacetic acid, 3-benzoyl-α-methyl-, (S)-, compd. with 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1)
  • Benzeneacetic acid, 3-benzoyl-α-methyl-, (αS)-, compd. with 2-amino-2-(hydroxymethyl)-1,3-propanediol (1:1)
  • 1,3-Propanediol, 2-amino-2-(hydroxymethyl)-, (S)-3-benzoyl-α-methylbenzeneacetate (salt)
  • 1,3-Propanediol, 2-amino-2-(hydroxymethyl)-, (αS)-3-benzoyl-α-methylbenzeneacetate (salt)

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration