1-Methylethyl 2-chloro-5-[5-[[5-cyano-1,6-dihydro-4-methyl-2,6-dioxo-1-(2-propen-1-yl)-3(2H)-pyridinylidene]methyl]-2-furanyl]benzoate

Base Information

• Chemical Name: 1-Methylethyl 2-chloro-5-[5-[[5-cyano-1,6-dihydro-4-methyl-2,6-dioxo-1-(2-propen-1-yl)-3(2H)-pyridinylidene]methyl]-2-furanyl]benzoate
• CAS No.: 445455-85-6
• Molecular Formula: C25H21ClN2O5
• Molecular Weight: 464.9
• DSSTox Substance ID: DTXSID501101866
• Mol file: 445455-85-6.mol

Synonyms:DTXSID501101866;1-Methylethyl 2-chloro-5-[5-[[5-cyano-1,6-dihydro-4-methyl-2,6-dioxo-1-(2-propen-1-yl)-3(2H)-pyridinylidene]methyl]-2-furanyl]benzoate;445455-85-6

Chemical Property of 1-Methylethyl 2-chloro-5-[5-[[5-cyano-1,6-dihydro-4-methyl-2,6-dioxo-1-(2-propen-1-yl)-3(2H)-pyridinylidene]methyl]-2-furanyl]benzoate

Chemical Property:

• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 464.1138995
• Heavy Atom Count: 33
• Complexity: 944

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Useful:

• Canonical SMILES: CC1=C(C(=O)N(C(=O)C1=CC2=CC=C(O2)C3=CC(=C(C=C3)Cl)C(=O)OC(C)C)CC=C)C#N

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