Benzyl 2-((trans-4-(guanidinomethyl)cyclohexanecarbonyl)oxy)benzoate

Catalog No. :
ACYUBQ076
CAS No. :
78718-52-2
Molecular Formula :
C23H27N3O4
Molecular Weight :
409.49

IUPAC Name:benzyl 2-(((1r,4r)-4-(guanidinomethyl)cyclohexane-1-carbonyl)oxy)benzoate

Benzyl 2-((trans-4-(guanidinomethyl)cyclohexanecarbonyl)oxy)benzoate structure diagram
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Product Information

Product NameBenzyl 2-((trans-4-(guanidinomethyl)cyclohexanecarbonyl)oxy)benzoate
IUPAC Namebenzyl 2-(((1r,4r)-4-(guanidinomethyl)cyclohexane-1-carbonyl)oxy)benzoate
MDL No.MFCD00866882
Molecular FormulaC23H27N3O4
Molecular Weight409.49
SMILESN=C(N)NC[C@H]1CC[C@H](C(=O)OC2=CC=CC=C2C(=O)OCC2=CC=CC=C2)CC1
InChI KeyIAXUQWSLRKIRFR-SAABIXHNSA-N
SynonymBENEXATE;benexate hydrochloride beta-cyclodextrin clathrate;Benxate;Benzoic acid, 2-[[[4-[[(aminoiminomethyl)amino]methyl]cyclohexyl]carbonyl]oxy]-, phenylmethyl ester, trans-;Benzoic acid, 2-[[[trans-4-[[(aminoiminomethyl)amino]methyl]cyclohexyl]carbonyl]oxy]-, phenylmethyl ester;2-[[[4α-(Guanidinomethyl)cyclohexane-1β-yl]carbonyl]oxy]benzoic acid phenylmethyl ester;4α-(Guanidinomethyl)-1β-cyclohexanecarboxylic acid 2-(benzyloxycarbonyl)phenyl ester;4α-(Guanidinomethyl)-1β-cyclohexanecarboxylic acid o-(benzyloxycarbonyl)phenyl ester
CAS No.78718-52-2

Synthetic Route by SureRoute

1. ACYUBQ076 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACUXKC847 route compound structure diagram
    ACUXKC847118-58-1 In Stock
  4. Then
  5. ACYUBQ076 route product structure diagram
    ACYUBQ07678718-52-2
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2. ACYUBQ076 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACUXKC847 route compound structure diagram
    ACUXKC847118-58-1 In Stock
  4. Then
  5. ACYUBQ076 route product structure diagram
    ACYUBQ07678718-52-2
Inquiry

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