3-(Octahydrobenzo[e][1,4]oxazepin-1(5H)-yl)-3-oxopropanenitrile

Catalog No. :
ACRXYI239
CAS No. :
2097956-20-0
Molecular Formula :
C12H18N2O2
Molecular Weight :
222.29

IUPAC Name:3-(octahydrobenzo[e][1,4]oxazepin-1(5H)-yl)-3-oxopropanenitrile

3-(Octahydrobenzo[e][1,4]oxazepin-1(5H)-yl)-3-oxopropanenitrile structure diagram
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Product Information

Product Name3-(Octahydrobenzo[e][1,4]oxazepin-1(5H)-yl)-3-oxopropanenitrile
IUPAC Name3-(octahydrobenzo[e][1,4]oxazepin-1(5H)-yl)-3-oxopropanenitrile
MDL No.MFCD29998902
Molecular FormulaC12H18N2O2
Molecular Weight222.29
SMILESN#CCC(N1CCOCC2C1CCCC2)=O
InChI KeyLXPJARPARAZQFY-UHFFFAOYSA-N
Synonym4,1-Benzoxazepine-1(5H)-propanenitrile, octahydro-β-oxo-;3-(octahydrobenzo[e][1,4]oxazepin-1(5h)-yl)-3-oxopropanenitrile
CAS No.2097956-20-0

Synthetic Route by SureRoute

1. ACRXYI239 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACMCAP915 route compound structure diagram
    ACMCAP9151071-36-9 In Stock
  4. Then
  5. ACRXYI239 route product structure diagram
    ACRXYI2392097956-20-0
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2. ACRXYI239 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACFXPJ467 route compound structure diagram
    ACFXPJ46713963-58-1 In Stock
  4. Then
  5. ACRXYI239 route product structure diagram
    ACRXYI2392097956-20-0
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