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Substance Name: EINECS 257-084-9
RN: 51248-73-8
InChIKey: KKDFDCUNVXQWKF-BYYHNAKLSA-N

Molecular Formula

  • C23-H25-Cl-N6-O6

Molecular Weight

  • 516.94
 
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Names and Synonyms

Results Name

  • EINECS 257-084-9

Synonyms

  • EINECS 257-084-9
  • N-(4-((2-Chloro-4-nitrophenyl)azo)-3-(acetylamino)phenyl)-N-(2-cyanoethyl)-beta-alanine, 2-methoxyethyl ester

Systematic Names

  • 2-Methoxyethyl N-(3-(acetylamino)-4-((2-chloro-4-nitrophenyl)azo)phenyl)-N-(2-cyanoethyl)-beta-alaninate
  • beta-Alanine, N-(3-(acetylamino)-4-((2-chloro-4-nitrophenyl)azo)phenyl)-N-(2-cyanoethyl)-, 2-methoxyethyl ester
  • beta-Alanine, N-(3-(acetylamino)-4-(2-(2-chloro-4-nitrophenyl)diazenyl)phenyl)-N-(2-cyanoethyl)-, 2-methoxyethyl ester

Registry Numbers

CAS Registry Number

  • 51248-73-8

System Generated Number

  • 0051248738

Structure Descriptors

InChI

1S/C23H25ClN6O6/c1-16(31)26-22-15-17(29(10-3-9-25)11-8-23(32)36-13-12-35-2)4-7-21(22)28-27-20-6-5-18(30(33)34)14-19(20)24/h4-7,14-15H,3,8,10-13H2,1-2H3,(H,26,31)/b28-27+

InChIKey

KKDFDCUNVXQWKF-BYYHNAKLSA-N

Smiles

C(CCN(CCC#N)c1cc(c(cc1)\N=N\c1c(cc(cc1)[N+](=O)[O-])Cl)NC(=O)C)(=O)OCCOC