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CAS 192436-84-3

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Methyl (2S,3aS,7aS)-octahydro-1H-indole-2-carboxylate

Description:
Methyl (2S,3aS,7aS)-octahydro-1H-indole-2-carboxylate is a chemical compound characterized by its bicyclic structure, which includes an indole moiety. This compound features a carboxylate ester functional group, contributing to its reactivity and solubility properties. The stereochemistry indicated by the (2S,3aS,7aS) configuration suggests specific spatial arrangements of the substituents around the chiral centers, which can influence its biological activity and interactions. Typically, compounds of this nature may exhibit properties relevant to medicinal chemistry, potentially serving as intermediates in the synthesis of pharmaceuticals or as bioactive agents. The presence of the methyl ester group enhances its lipophilicity, which can affect its absorption and distribution in biological systems. Additionally, the octahydroindole framework is often associated with various pharmacological activities, making it a subject of interest in drug development. Overall, this compound's unique structural features and functional groups contribute to its potential applications in various chemical and biological contexts.
Formula:C10H17NO2
InChI:InChI=1S/C10H17NO2/c1-13-10(12)9-6-7-4-2-3-5-8(7)11-9/h7-9,11H,2-6H2,1H3/t7-,8-,9-/m0/s1
InChI key:InChIKey=OITFEJDUSSGRIH-CIUDSAMLSA-N
SMILES:C(OC)(=O)[C@@H]1C[C@]2([C@@](N1)(CCCC2)[H])[H]
Synonyms:
  • 1H-Indole-2-carboxylic acid, octahydro-, methyl ester, [2S-(2α,3aβ,7aβ)]-
  • Methyl (2S,3aS,7aS)-octahydro-1H-indole-2-carboxylate
  • 1H-Indole-2-carboxylic acid, octahydro-, methyl ester, (2S,3aS,7aS)-
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