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Substance Name: O,O'-Didodecyl-N-(4-(2-trimethylammonioethyloxy)benzoyl)-glutamte
RN: 79508-19-3
InChIKey: ODAIVLGJHKYGAD-KYYDUREMSA-N

Molecular Formula

  • C41-H73-N2-O6.Br

Molecular Weight

  • 769.9397
 
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Names and Synonyms

Name of Substance

  • O,O'-Didodecyl-N-(4-(2-trimethylammonioethyloxy)benzoyl)-glutamte

Synonyms

  • (S)-2-(4-(((4-(Dodecyloxy)-1-((dodecyloxy)carbonyl)-4-oxobutyl)amino)carbonyl)phenoxy)-N,N,N-trimethylethanaminium bromide
  • 2C12-Glu-ph-C2-N+

Systematic Name

  • Ethanaminium, 2-(4-(((4-(dodecyloxy)-1-((dodecyloxy)carbonyl)-4-oxobutyl)amino)carbonyl)phenoxy)-N,N,N-trimethyl-, bromide, (S)-

Registry Numbers

CAS Registry Number

  • 79508-19-3

System Generated Number

  • 0079508193

Molecular Formulas

Molecular Formula

  • C41-H73-N2-O6.Br

Molecular Formula Fragments

  • Br
  • C41-H73-N2-O6
  • COMPONENT

Structure Descriptors

InChI

1S/C41H72N2O6.BrH/c1-6-8-10-12-14-16-18-20-22-24-33-48-39(44)31-30-38(41(46)49-34-25-23-21-19-17-15-13-11-9-7-2)42-40(45)36-26-28-37(29-27-36)47-35-32-43(3,4)5;/h26-29,38H,6-25,30-35H2,1-5H3;1H/t38-;/m0./s1

InChIKey

ODAIVLGJHKYGAD-KYYDUREMSA-N

Smiles

CCCCCCCCCCCCOC(=O)CC[C@@H](C(=O)OCCCCCCCCCCCC)NC(=O)c1ccc(cc1)OCC[N+](C)(C)C.[Br-]