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Substance Name: Propanenitrile, 3-((2-(acetyloxy)ethyl)(4-(2-(2-(methylsulfonyl)-4-nitrophenyl)diazenyl)phenyl)amino)-
RN: 63467-08-3
InChIKey: BBCMFXGIGGXVPH-GHVJWSGMSA-N

Molecular Formula

  • C20-H21-N5-O6-S

Molecular Weight

  • 459.481
 
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Names and Synonyms

Synonym

  • EINECS 264-221-6

Systematic Names

  • 2-((2-Cyanoethyl)(4-((2-(methylsulphonyl)-4-nitrophenyl)azo)phenyl)amino)ethyl acetate
  • Propanenitrile, 3-((2-(acetyloxy)ethyl)(4-((2-(methylsulfonyl)-4-nitrophenyl)azo)phenyl)amino)-
  • Propanenitrile, 3-((2-(acetyloxy)ethyl)(4-(2-(2-(methylsulfonyl)-4-nitrophenyl)diazenyl)phenyl)amino)-

Registry Numbers

CAS Registry Number

  • 63467-08-3

System Generated Number

  • 0063467083

Structure Descriptors

InChI

1S/C20H21N5O6S/c1-15(26)31-13-12-24(11-3-10-21)17-6-4-16(5-7-17)22-23-19-9-8-18(25(27)28)14-20(19)32(2,29)30/h4-9,14H,3,11-13H2,1-2H3/b23-22+

InChIKey

BBCMFXGIGGXVPH-GHVJWSGMSA-N

Smiles

O=C(OCCN(c1ccc(\N=N\c2c(S(=O)(=O)C)cc([N+]([O-])=O)cc2)cc1)CCC#N)C