1,1-Dimethylethyl 4-bromo-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoate

CAS Registry Number®

1628047-84-6
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CAS Name

1,1-Dimethylethyl 4-bromo-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoate

Molecular Formula

C18H17BrN2O3

Molecular Mass

389.24

Cite this Page

1,1-Dimethylethyl 4-bromo-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1628047-84-6 (retrieved 2024-09-06) (CAS RN: 1628047-84-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H17BrN2O3/c1-18(2,3)24-17(22)14-5-4-12(19)9-15(14)23-13-8-11-6-7-20-16(11)21-10-13/h4-10H,1-3H3,(H,20,21)

InChIKey

InChIKey=QTUZSJSEZUZNAS-UHFFFAOYSA-N

SMILES

C(OC(C)(C)C)(=O)C1=C(OC=2C=C3C(=NC2)NC=C3)C=C(Br)C=C1

Canonical SMILES

O=C(OC(C)(C)C)C1=CC=C(Br)C=C1OC=2C=NC=3NC=CC3C2

Other Names for this Substance

  • Benzoic acid, 4-bromo-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 4-bromo-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoate