N-(2-Cyanoethyl)-N-[4-[2-(2-cyano-4-nitrophenyl)diazenyl]phenyl]-β-alanine methyl ester

CAS Registry Number®

27767-98-2
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CAS Name

N-(2-Cyanoethyl)-N-[4-[2-(2-cyano-4-nitrophenyl)diazenyl]phenyl]-β-alanine methyl ester

Molecular Formula

C20H18N6O4

Molecular Mass

406.39

Cite this Page

N-(2-Cyanoethyl)-N-[4-[2-(2-cyano-4-nitrophenyl)diazenyl]phenyl]-β-alanine methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=27767-98-2 (retrieved 2024-05-19) (CAS RN: 27767-98-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H18N6O4/c1-30-20(27)9-12-25(11-2-10-21)17-5-3-16(4-6-17)23-24-19-8-7-18(26(28)29)13-15(19)14-22/h3-8,13H,2,9,11-12H2,1H3

InChIKey

InChIKey=CUPYBRUIBNYSDK-UHFFFAOYSA-N

SMILES

N(CCC(OC)=O)(CCC#N)C1=CC=C(N=NC2=C(C#N)C=C(N(=O)=O)C=C2)C=C1

Canonical SMILES

N#CC1=CC(=CC=C1N=NC2=CC=C(C=C2)N(CCC#N)CCC(=O)OC)N(=O)=O

Other Names for this Substance

  • β-Alanine, N-(2-cyanoethyl)-N-[4-[2-(2-cyano-4-nitrophenyl)diazenyl]phenyl]-, methyl ester
  • β-Alanine, N-(2-cyanoethyl)-N-[4-[(2-cyano-4-nitrophenyl)azo]phenyl]-, methyl ester
  • β-Alanine, N-(2-cyanoethyl)-N-[p-[(2-cyano-4-nitrophenyl)azo]phenyl]-, methyl ester
  • N-(2-Cyanoethyl)-N-[4-[2-(2-cyano-4-nitrophenyl)diazenyl]phenyl]-β-alanine methyl ester
  • C.I. Disperse Red 90

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Deleted or Replaced CAS Registry Numbers

12223-46-0

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