Methyl N-[3-(Acetylamino)-4-[(2-Cyano-4-Nitrophenyl)Azo]Phenyl]-N-Ethyl-beta-Alaninate
[CAS# 72595-17-6]

Identification

• Name: Methyl N-[3-(Acetylamino)-4-[(2-Cyano-4-Nitrophenyl)Azo]Phenyl]-N-Ethyl-beta-Alaninate
• Synonyms: Methyl 3-[[3-Acetamido-4-(2-Cyano-4-Nitro-Phenyl)Azo-Phenyl]-Ethyl-Amino]Propanoate; 3-[[3-Acetamido-4-(2-Cyano-4-Nitrophenyl)Azophenyl]-Ethylamino]Propanoic Acid Methyl Ester; 3-[[3-Acetamido-4-(2-Cyano-4-Nitro-Phenyl)Azo-Phenyl]-Ethyl-Amino]Propionic Acid Methyl Ester
• Molecular Formula: C₂₁H₂₂N₆O₅
• Molecular Weight: 438.44
• CAS Registry Number: 72595-17-6
• EINECS: 276-727-4
• SMILES: C1=CC(=C(C=C1[N+]([O-])=O)C#N)N=NC2=C(C=C(C=C2)N(CC)CCC(=O)OC)NC(=O)C
• InChI: 1S/C21H22N6O5/c1-4-26(10-9-21(29)32-3)16-5-8-19(20(12-16)23-14(2)28)25-24-18-7-6-17(27(30)31)11-15(18)13-22/h5-8,11-12H,4,9-10H2,1-3H3,(H,23,28)
• InChIKey: IHGNMANWSZRSPH-UHFFFAOYSA-N