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CAS 914349-28-3

:

1,1-Dimethylethyl 3-bromo-5-(phenylmethoxy)-1H-indole-1-carboxylate

Description:
1,1-Dimethylethyl 3-bromo-5-(phenylmethoxy)-1H-indole-1-carboxylate, identified by its CAS number 914349-28-3, is a synthetic organic compound characterized by its complex structure, which includes an indole ring, a carboxylate group, and a bromine atom. The presence of the 1,1-dimethylethyl group contributes to its steric bulk, potentially influencing its reactivity and solubility. The phenylmethoxy substituent enhances its lipophilicity, which may affect its biological activity and interactions with other molecules. This compound may exhibit interesting pharmacological properties due to the indole moiety, which is often associated with various biological activities, including anti-inflammatory and anticancer effects. Its synthesis and characterization would typically involve standard organic chemistry techniques, including NMR spectroscopy and mass spectrometry, to confirm its structure and purity. Overall, this compound represents a class of indole derivatives that could be of interest in medicinal chemistry and drug development.
Formula:C20H20BrNO3
InChI:InChI=1S/C20H20BrNO3/c1-20(2,3)25-19(23)22-12-17(21)16-11-15(9-10-18(16)22)24-13-14-7-5-4-6-8-14/h4-12H,13H2,1-3H3
InChI key:InChIKey=NHBAORGFRKXFIJ-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1C=2C(=CC(OCC3=CC=CC=C3)=CC2)C(Br)=C1
Synonyms:
  • 1,1-Dimethylethyl 3-bromo-5-(phenylmethoxy)-1H-indole-1-carboxylate
  • 1-Boc-5-Benzyloxy-3-bromoindole
  • 1H-Indole-1-carboxylic acid, 3-bromo-5-(phenylmethoxy)-, 1,1-dimethylethyl ester
  • tert-Butyl 5-(benzyloxy)-3-bromo-1H-indole-1-carboxylate
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