N-(2-Cyanoethyl)-N-[4-[2-(2-Cyano-4-Nitrophenyl)Diazenyl]Phenyl]-beta-Alanine Methyl Ester
[CAS# 27767-98-2]

Identification

• Name: N-(2-Cyanoethyl)-N-[4-[2-(2-Cyano-4-Nitrophenyl)Diazenyl]Phenyl]-beta-Alanine Methyl Ester
• Synonyms: Methyl 3-[2-Cyanoethyl-[4-(2-Cyano-4-Nitro-Phenyl)Azophenyl]Amino]Propanoate; 3-[2-Cyanoethyl-[4-(2-Cyano-4-Nitrophenyl)Azophenyl]Amino]Propanoic Acid Methyl Ester; 3-[2-Cyanoethyl-[4-(2-Cyano-4-Nitro-Phenyl)Azophenyl]Amino]Propionic Acid Methyl Ester
• Molecular Formula: C₂₀H₁₈N₆O₄
• Molecular Weight: 406.40
• CAS Registry Number: 27767-98-2
• EINECS: 248-649-0
• SMILES: C1=CC(=C(C=C1[N+]([O-])=O)C#N)N=NC2=CC=C(C=C2)N(CCC#N)CCC(=O)OC
• 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: CUPYBRUIBNYSDK-UHFFFAOYSA-N