3-((2-(1-(6-((2,5-Dioxopyrrolidin-1-yl)oxy)-6-oxohexyl)pyridin-1-ium-4-yl)benzo[d]oxazol-6-yl)oxy)propane-1-sulfonate

Catalog No. :
ACIICY003
CAS No. :
1799413-07-2
Molecular Formula :
C25H27N3O9S
Molecular Weight :
545.57

IUPAC Name:3-((2-(1-(6-((2,5-dioxopyrrolidin-1-yl)oxy)-6-oxohexyl)pyridin-1-ium-4-yl)benzo[d]oxazol-6-yl)oxy)propane-1-sulfonate

3-((2-(1-(6-((2,5-Dioxopyrrolidin-1-yl)oxy)-6-oxohexyl)pyridin-1-ium-4-yl)benzo[d]oxazol-6-yl)oxy)propane-1-sulfonate structure diagram
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Product Information

Product Name3-((2-(1-(6-((2,5-Dioxopyrrolidin-1-yl)oxy)-6-oxohexyl)pyridin-1-ium-4-yl)benzo[d]oxazol-6-yl)oxy)propane-1-sulfonate
IUPAC Name3-((2-(1-(6-((2,5-dioxopyrrolidin-1-yl)oxy)-6-oxohexyl)pyridin-1-ium-4-yl)benzo[d]oxazol-6-yl)oxy)propane-1-sulfonate
Molecular FormulaC25H27N3O9S
Molecular Weight545.57
SMILESO=C(CCCCC[N+]1=CC=C(C2=NC3=CC=C(OCCCS(=O)(=O)[O-])C=C3O2)C=C1)ON1C(=O)CCC1=O
InChI KeyBFIDJVPFOUXCFW-UHFFFAOYSA-N
SynonymPyridinium, 1-[6-[(2,5-dioxo-1-pyrrolidinyl)oxy]-6-oxohexyl]-4-[6-(3-sulfopropoxy)-2-benzoxazolyl]-, inner salt
CAS No.1799413-07-2

Synthetic Route by SureRoute

1. ACIICY003 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACIICY003 route product structure diagram
    ACIICY0031799413-07-2
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2. ACIICY003 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACPOQL635 route compound structure diagram
    ACPOQL6356066-82-6 In Stock
  4. Then
  5. ACIICY003 route product structure diagram
    ACIICY0031799413-07-2
Inquiry

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