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Substance Name: beta-Alanine, N-(5-(acetylamino)-4-(2-(2-bromo-4,6-dinitrophenyl)diazenyl)-2-methoxyphenyl)-N-ethyl-, 2-methoxyethyl ester
RN: 42861-47-2
InChIKey: LOBGJBGIERWYHR-CYYJNZCTSA-N

Molecular Formula

  • C23-H27-Br-N6-O9

Molecular Weight

  • 611.403
 
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Names and Synonyms

Synonyms

  • EINECS 255-972-0
  • N-Ethyl-N-(4-((2-bromo-4,6-dinitrophenyl)azo)-5-(acetylamino)-2-methoxyphenyl)-beta-alanine 2-methoxyethyl ester
  • N-Ethyl-N-(4-((2-bromo-4,6-dinitrophenyl)azo)-5-(acetylamino)-2-methoxyphenyl)-beta-alanine, 2-methoxyethyl ester

Systematic Names

  • 2-Methoxyethyl N-(5-(acetylamino)-4-((2-bromo-4,6-dinitrophenyl)azo)-2-methoxyphenyl)-N-ethyl-beta-alaninate
  • beta-Alanine, N-(5-(acetylamino)-4-((2-bromo-4,6-dinitrophenyl)azo)-2-methoxyphenyl)-N-ethyl-, 2-methoxyethyl ester
  • beta-Alanine, N-(5-(acetylamino)-4-(2-(2-bromo-4,6-dinitrophenyl)diazenyl)-2-methoxyphenyl)-N-ethyl-, 2-methoxyethyl ester

Registry Numbers

CAS Registry Number

  • 42861-47-2

System Generated Number

  • 0042861472

Structure Descriptors

InChI

1S/C23H27BrN6O9/c1-5-28(7-6-22(32)39-9-8-37-3)19-12-17(25-14(2)31)18(13-21(19)38-4)26-27-23-16(24)10-15(29(33)34)11-20(23)30(35)36/h10-13H,5-9H2,1-4H3,(H,25,31)/b27-26+

InChIKey

LOBGJBGIERWYHR-CYYJNZCTSA-N

Smiles

C(CCN(CC)c1c(cc(c(c1)NC(=O)C)\N=N\c1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])Br)OC)(=O)OCCOC