3,5-Dichloro-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenepropanoic acid

CAS Registry Number®

188812-96-6

CAS Name

3,5-Dichloro-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenepropanoic acid

Molecular Formula

C14H17Cl2NO4

Molecular Mass

334.20

Cite this Page

3,5-Dichloro-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenepropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=188812-96-6 (retrieved 2024-10-05) (CAS RN: 188812-96-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H17Cl2NO4/c1-14(2,3)21-13(20)17-11(7-12(18)19)8-4-9(15)6-10(16)5-8/h4-6,11H,7H2,1-3H3,(H,17,20)(H,18,19)

InChIKey

InChIKey=NMXNAYGOUOQUPC-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(OC(C)(C)C)NC(C=1C=C(Cl)C=C(Cl)C1)CC(=O)O

Other Names for this Substance

  • Benzenepropanoic acid, 3,5-dichloro-β-[[(1,1-dimethylethoxy)carbonyl]amino]-
  • 3,5-Dichloro-β-[[(1,1-dimethylethoxy)carbonyl]amino]benzenepropanoic acid
  • 3-[[(tert-Butoxy)carbonyl]amino]-3-(3,5-dichlorophenyl)propanoic acid

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