3-Ethyl-1,1,2-trimethyl-8-sulfo-1H-benzo[e]indol-3-ium-6-sulfonate

Catalog No. :
ACBUHM518
CAS No. :
791576-54-0
Molecular Formula :
C17H19NO6S2
Molecular Weight :
397.47

IUPAC Name:3-ethyl-1,1,2-trimethyl-8-sulfo-1H-benzo[e]indol-3-ium-6-sulfonate

3-Ethyl-1,1,2-trimethyl-8-sulfo-1H-benzo[e]indol-3-ium-6-sulfonate structure diagram
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Product Information

Product Name3-Ethyl-1,1,2-trimethyl-8-sulfo-1H-benzo[e]indol-3-ium-6-sulfonate
IUPAC Name3-ethyl-1,1,2-trimethyl-8-sulfo-1H-benzo[e]indol-3-ium-6-sulfonate
Molecular FormulaC17H19NO6S2
Molecular Weight397.47
SMILESO=S(C1=C2C(C3=C([N+](CC)=C(C)C3(C)C)C=C2)=CC(S(=O)(O)=O)=C1)([O-])=O
InChI KeyIFEVREBSSNSVFH-UHFFFAOYSA-N
Synonym2,3,3-trimethyl-1-(ethyl)-3H-benzindolinium-5,7-disulfonate
CAS No.791576-54-0

Synthetic Route by SureRoute

1. ACBUHM518 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. ACBUHM518 route product structure diagram
    ACBUHM518791576-54-0
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2. ACBUHM518 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. ACBUHM518 route product structure diagram
    ACBUHM518791576-54-0
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