3-Nitro-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)benzoic acid

Catalog No. :
ACCGJV187
CAS No. :
447413-51-6
Molecular Formula :
C17H22N2O4
Molecular Weight :
318.37

IUPAC Name:3-nitro-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)benzoic acid

3-Nitro-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)benzoic acid structure diagram
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Product Information

Product Name3-Nitro-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)benzoic acid
IUPAC Name3-nitro-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)benzoic acid
Molecular FormulaC17H22N2O4
Molecular Weight318.37
SMILESO=C(O)C1=CC=C(N2C3CC(C)(C)CC(C3)(C)C2)C([N+]([O-])=O)=C1
InChI KeyKYQBVAJBHJTDDX-UHFFFAOYSA-N
Synonym3-NITRO-4-(1,3,3-TRIMETHYL-6-AZABICYCLO[3.2.1]OCT-6-YL)BENZOIC ACID;Benzoic acid, 3-nitro-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)-;3-Nitro-4-(1,3,3-trimethyl-6-azabicyclo[3.2.1]Octan-6-yl)benzoic acid
CAS No.447413-51-6

Synthetic Route by SureRoute

1. ACCGJV187 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACOEWU095 route compound structure diagram
    ACOEWU09596-99-1 In Stock
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  5. ACCGJV187 route product structure diagram
    ACCGJV187447413-51-6
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2. ACCGJV187 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACNDVA817 route compound structure diagram
    ACNDVA817453-71-4 In Stock
  4. Then
  5. ACCGJV187 route product structure diagram
    ACCGJV187447413-51-6
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