N-Acetyl-L-tryptophan 3,5-bis(trifluoromethyl)benzyl ester

CAS Registry Number®

148451-96-1

CAS Name

N-Acetyl-L-tryptophan 3,5-bis(trifluoromethyl)benzyl ester

Molecular Formula

C22H18F6N2O3

Molecular Mass

472.38

Cite this Page

N-Acetyl-L-tryptophan 3,5-bis(trifluoromethyl)benzyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=148451-96-1 (retrieved 2024-11-22) (CAS RN: 148451-96-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H18F6N2O3/c1-12(31)30-19(8-14-10-29-18-5-3-2-4-17(14)18)20(32)33-11-13-6-15(21(23,24)25)9-16(7-13)22(26,27)28/h2-7,9-10,19,29H,8,11H2,1H3,(H,30,31)/t19-/m0/s1

InChIKey

InChIKey=BYYQYXVAWXAYQC-IBGZPJMESA-N

SMILES

C([C@@H](C(OCC1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1)=O)NC(C)=O)C=2C=3C(NC2)=CC=CC3

Canonical SMILES

O=C(OCC=1C=C(C=C(C1)C(F)(F)F)C(F)(F)F)C(NC(=O)C)CC2=CNC=3C=CC=CC32

Other Names for this Substance

  • L-Tryptophan, N-acetyl-, [3,5-bis(trifluoromethyl)phenyl]methyl ester
  • L 732138
  • N-Acetyltryptophan 3,5-bis(trifluoromethyl)benzyl ester
  • N-Acetyl-L-tryptophan 3,5-bis(trifluoromethyl)benzyl ester
  • (S)-3,5-Bis(trifluoromethyl)benzyl 2-acetamido-3-(1H-indol-3-yl)propanoate

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