Ethyl 1-(2,4-bis(trifluoromethyl)benzyl)-7-oxoazepane-4-carboxylate

Catalog No. :
ACPDEQ918
CAS No. :
1422129-63-2
Molecular Formula :
C18H19F6NO3
Molecular Weight :
411.34

IUPAC Name:ethyl 1-(2,4-bis(trifluoromethyl)benzyl)-7-oxoazepane-4-carboxylate

Ethyl 1-(2,4-bis(trifluoromethyl)benzyl)-7-oxoazepane-4-carboxylate structure diagram
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Product Information

Product NameEthyl 1-(2,4-bis(trifluoromethyl)benzyl)-7-oxoazepane-4-carboxylate
IUPAC Nameethyl 1-(2,4-bis(trifluoromethyl)benzyl)-7-oxoazepane-4-carboxylate
Molecular FormulaC18H19F6NO3
Molecular Weight411.34
SMILESO=C(C1CCC(N(CC1)CC2=CC=C(C(F)(F)F)C=C2C(F)(F)F)=O)OCC
InChI KeySHCQCAVKGAIUBW-UHFFFAOYSA-N
Synonym1H-Azepine-4-carboxylic acid, 1-[[2,4-bis(trifluoromethyl)phenyl]methyl]hexahydro-7-oxo-, ethyl ester
CAS No.1422129-63-2

Synthetic Route by SureRoute

1. ACPDEQ918 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  2. Plus
  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACPDEQ918 route product structure diagram
    ACPDEQ9181422129-63-2
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2. ACPDEQ918 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACONYL130 route compound structure diagram
    ACONYL130195136-46-0 In Stock
  4. Then
  5. ACPDEQ918 route product structure diagram
    ACPDEQ9181422129-63-2
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