1-(1,1-Dimethylethyl) 4-(4-borono-3-chloro-2-pyridinyl)-1-piperazinecarboxylate

CAS Registry Number®

1704063-46-6
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CAS Name

1-(1,1-Dimethylethyl) 4-(4-borono-3-chloro-2-pyridinyl)-1-piperazinecarboxylate

Molecular Formula

C14H21BClN3O4

Molecular Mass

341.60

Cite this Page

1-(1,1-Dimethylethyl) 4-(4-borono-3-chloro-2-pyridinyl)-1-piperazinecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1704063-46-6 (retrieved 2024-07-01) (CAS RN: 1704063-46-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H21BClN3O4/c1-14(2,3)23-13(20)19-8-6-18(7-9-19)12-11(16)10(15(21)22)4-5-17-12/h4-5,21-22H,6-9H2,1-3H3

InChIKey

InChIKey=RSWQGMQFHJIAEX-UHFFFAOYSA-N

SMILES

ClC1=C(N=CC=C1B(O)O)N2CCN(C(OC(C)(C)C)=O)CC2

Canonical SMILES

O=C(OC(C)(C)C)N1CCN(C2=NC=CC(B(O)O)=C2Cl)CC1

Other Names for this Substance

  • 1-Piperazinecarboxylic acid, 4-(4-borono-3-chloro-2-pyridinyl)-, 1-(1,1-dimethylethyl) ester
  • 1-(1,1-Dimethylethyl) 4-(4-borono-3-chloro-2-pyridinyl)-1-piperazinecarboxylate