4-(Methoxycarbonyl)-β-[(2,2,2-trifluoroacetyl)amino]benzenepropanoic acid

CAS Registry Number®

886360-56-1

CAS Name

4-(Methoxycarbonyl)-β-[(2,2,2-trifluoroacetyl)amino]benzenepropanoic acid

Molecular Formula

C13H12F3NO5

Molecular Mass

319.23

Cite this Page

4-(Methoxycarbonyl)-β-[(2,2,2-trifluoroacetyl)amino]benzenepropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=886360-56-1 (retrieved 2024-11-22) (CAS RN: 886360-56-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H12F3NO5/c1-22-11(20)8-4-2-7(3-5-8)9(6-10(18)19)17-12(21)13(14,15)16/h2-5,9H,6H2,1H3,(H,17,21)(H,18,19)

InChIKey

InChIKey=NNFXBAVWSASERE-UHFFFAOYSA-N

SMILES

C(NC(C(F)(F)F)=O)(CC(O)=O)C1=CC=C(C(OC)=O)C=C1

Canonical SMILES

O=C(OC)C1=CC=C(C=C1)C(NC(=O)C(F)(F)F)CC(=O)O

Other Names for this Substance

  • Benzenepropanoic acid, 4-(methoxycarbonyl)-β-[(2,2,2-trifluoroacetyl)amino]-
  • Benzenepropanoic acid, 4-(methoxycarbonyl)-β-[(trifluoroacetyl)amino]-
  • 4-(Methoxycarbonyl)-β-[(2,2,2-trifluoroacetyl)amino]benzenepropanoic acid

CAS INSIGHTSTM
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