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AI61316

915369-16-3 | Ethyl 2-cyano-3-((2-(dimethylcarbamoyl)-4-nitrophenyl)imino)propanoate

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Description
Catalog Number: AI61316
Chemical Name: Ethyl 2-cyano-3-((2-(dimethylcarbamoyl)-4-nitrophenyl)imino)propanoate
CAS Number: 915369-16-3
Molecular Formula: C15H16N4O5
Molecular Weight: 332.3113
MDL Number: MFCD28991955
SMILES: CCOC(=O)C(C=Nc1ccc(cc1C(=O)N(C)C)[N+](=O)[O-])C#N

 

Computed Properties
Complexity: 560  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 24  
Hydrogen Bond Acceptor Count: 7  
Rotatable Bond Count: 6  
Undefined Atom Stereocenter Count: 1  
XLogP3: 1.2  

 

 

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