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Substance Name: 1-(1-(((Benzyloxy)carbonyl)amino)-2,2,2-trifluoroethyl)-N-(tert-butoxycarbonyl)-L-histidine
RN: 7682-45-3
InChIKey: MXBLBDHOSUWYDH-MYJWUSKBSA-N

Molecular Formula

  • C21-H25-F3-N4-O6

Molecular Weight

  • 486.444
 
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Names and Synonyms

Synonym

  • EINECS 231-684-0

Systematic Names

  • 1-(1-(((Benzyloxy)carbonyl)amino)-2,2,2-trifluoroethyl)-N-(tert-butoxycarbonyl)-L-histidine
  • Histidine, N-carboxy-1-(1-(carboxyamino)-2,2,2-trifluoroethyl)-, benzyl tert-butyl ester
  • Histidine, N-carboxy-1-(1-(carboxyamino)-2,2,2-trifluoroethyl)-, monobenzyl N-tert-butyl ester, L-
  • L-Histidine, N-((1,1-dimethylethoxy)carbonyl)-1-(2,2,2-trifluoro-1-(((phenylmethoxy)carbonyl)amino)ethyl)-

Registry Numbers

CAS Registry Number

  • 7682-45-3

System Generated Number

  • 0007682453

Structure Descriptors

InChI

1S/C21H25F3N4O6/c1-20(2,3)34-19(32)26-15(16(29)30)9-14-10-28(12-25-14)17(21(22,23)24)27-18(31)33-11-13-7-5-4-6-8-13/h4-8,10,12,15,17H,9,11H2,1-3H3,(H,26,32)(H,27,31)(H,29,30)/t15-,17?/m0/s1

InChIKey

MXBLBDHOSUWYDH-MYJWUSKBSA-N

Smiles

n1([C@@H](NC(=O)OCc2ccccc2)C(F)(F)F)cnc(c1)C[C@H](NC(OC(C)(C)C)=O)C(=O)O