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CAS 914349-30-7

:

1,1-Dimethylethyl 3-iodo-6-(phenylmethoxy)-1H-indole-1-carboxylate

Description:
1,1-Dimethylethyl 3-iodo-6-(phenylmethoxy)-1H-indole-1-carboxylate, identified by its CAS number 914349-30-7, is a chemical compound that features a complex structure typical of indole derivatives. This substance contains an indole ring, which is a bicyclic structure composed of a benzene ring fused to a pyrrole ring, contributing to its aromatic properties. The presence of the iodo group introduces significant reactivity, making it useful in various synthetic applications, particularly in medicinal chemistry. The phenylmethoxy group enhances its lipophilicity, potentially improving its bioavailability. Additionally, the tert-butyl group (1,1-dimethylethyl) provides steric hindrance, which can influence the compound's interaction with biological targets. Overall, this compound may exhibit interesting pharmacological properties, making it a candidate for further research in drug development. Its unique combination of functional groups suggests potential applications in areas such as organic synthesis and medicinal chemistry, although specific biological activities would require empirical investigation.
Formula:C20H20INO3
InChI:InChI=1S/C20H20INO3/c1-20(2,3)25-19(23)22-12-17(21)16-10-9-15(11-18(16)22)24-13-14-7-5-4-6-8-14/h4-12H,13H2,1-3H3
InChI key:InChIKey=WSQPBBGPYIEBLQ-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1C=2C(C(I)=C1)=CC=C(OCC3=CC=CC=C3)C2
Synonyms:
  • 1H-Indole-1-carboxylic acid, 3-iodo-6-(phenylmethoxy)-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 3-iodo-6-(phenylmethoxy)-1H-indole-1-carboxylate
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