1-(1,1-Dimethylethyl) 2-borono-4-(phenylmethoxy)-1H-indole-1-carboxylate

CAS Registry Number®

850568-52-4

CAS Name

1-(1,1-Dimethylethyl) 2-borono-4-(phenylmethoxy)-1H-indole-1-carboxylate

Molecular Formula

C20H22BNO5

Molecular Mass

367.20

Cite this Page

1-(1,1-Dimethylethyl) 2-borono-4-(phenylmethoxy)-1H-indole-1-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=850568-52-4 (retrieved 2024-11-22) (CAS RN: 850568-52-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H22BNO5/c1-20(2,3)27-19(23)22-16-10-7-11-17(15(16)12-18(22)21(24)25)26-13-14-8-5-4-6-9-14/h4-12,24-25H,13H2,1-3H3

InChIKey

InChIKey=YXJBIADEQVCONT-UHFFFAOYSA-N

SMILES

C(OC(C)(C)C)(=O)N1C=2C(=C(OCC3=CC=CC=C3)C=CC2)C=C1B(O)O

Canonical SMILES

O=C(OC(C)(C)C)N1C(=CC=2C(OCC=3C=CC=CC3)=CC=CC21)B(O)O

Other Names for this Substance

  • 1H-Indole-1-carboxylic acid, 2-borono-4-(phenylmethoxy)-, 1-(1,1-dimethylethyl) ester
  • 1-(1,1-Dimethylethyl) 2-borono-4-(phenylmethoxy)-1H-indole-1-carboxylate
  • [4-[(Benzyl)oxy]-1-(tert-butoxycarbonyl)-1H-indol-2-yl]boronic acid

Deleted or Replaced CAS Registry Numbers

1004552-90-2

CAS INSIGHTSTM
Targeted protein degrader structure, illustration