4-[(1,1-Dimethylethoxy)carbonyl]-α-[2-(trifluoromethyl)phenyl]-1-piperazineacetic acid

CAS Registry Number®

885274-23-7

CAS Name

4-[(1,1-Dimethylethoxy)carbonyl]-α-[2-(trifluoromethyl)phenyl]-1-piperazineacetic acid

Molecular Formula

C18H23F3N2O4

Molecular Mass

388.38

Cite this Page

4-[(1,1-Dimethylethoxy)carbonyl]-α-[2-(trifluoromethyl)phenyl]-1-piperazineacetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=885274-23-7 (retrieved 2024-11-25) (CAS RN: 885274-23-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H23F3N2O4/c1-17(2,3)27-16(26)23-10-8-22(9-11-23)14(15(24)25)12-6-4-5-7-13(12)18(19,20)21/h4-7,14H,8-11H2,1-3H3,(H,24,25)

InChIKey

InChIKey=IYIQZDBAVIZZOC-UHFFFAOYSA-N

SMILES

C(C(O)=O)(C1=C(C(F)(F)F)C=CC=C1)N2CCN(C(OC(C)(C)C)=O)CC2

Canonical SMILES

O=C(OC(C)(C)C)N1CCN(CC1)C(C(=O)O)C=2C=CC=CC2C(F)(F)F

Other Names for this Substance

  • 1-Piperazineacetic acid, 4-[(1,1-dimethylethoxy)carbonyl]-α-[2-(trifluoromethyl)phenyl]-
  • 4-[(1,1-Dimethylethoxy)carbonyl]-α-[2-(trifluoromethyl)phenyl]-1-piperazineacetic acid

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