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Substance Name: beta-Alanine, N-(5-(acetylamino)-4-(2-(2-bromo-4,6-dinitrophenyl)diazenyl)-2-methoxyphenyl)-, 2-methoxyethyl ester
RN: 6522-67-4
InChIKey: ASPNMPVSOMVHRA-OCEACIFDSA-N

Molecular Formula

  • C21-H23-Br-N6-O9

Molecular Weight

  • 583.35
 
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Names and Synonyms

Synonyms

  • EINECS 229-411-5
  • N-(5-(Acetylamino)-4-((2-bromo-4,6-dinitrophenyl)azo)-2-methoxyphenyl)-beta-alanine, 2-methoxyethyl ester

Systematic Names

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

Registry Numbers

CAS Registry Number

  • 6522-67-4

System Generated Number

  • 0006522674

Structure Descriptors

InChI

1S/C21H23BrN6O9/c1-12(29)24-15-10-17(23-5-4-20(30)37-7-6-35-2)19(36-3)11-16(15)25-26-21-14(22)8-13(27(31)32)9-18(21)28(33)34/h8-11,23H,4-7H2,1-3H3,(H,24,29)/b26-25+

InChIKey

ASPNMPVSOMVHRA-OCEACIFDSA-N

Smiles

O=C(Nc1c(\N=N\c2c(cc([N+]([O-])=O)cc2[N+](=O)[O-])Br)cc(OC)c(NCCC(=O)OCCOC)c1)C