1,1-Dimethylethyl N-[2-[7-[2-(4-cyano-2-fluorophenoxy)ethyl]-9-oxa-3,7-diazabicyclo[3.3.1]non-3-yl]ethyl]carbamate

CAS Registry Number®

872045-91-5
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CAS Name

1,1-Dimethylethyl N-[2-[7-[2-(4-cyano-2-fluorophenoxy)ethyl]-9-oxa-3,7-diazabicyclo[3.3.1]non-3-yl]ethyl]carbamate

Molecular Formula

C22H31FN4O4

Molecular Mass

434.50

Cite this Page

1,1-Dimethylethyl N-[2-[7-[2-(4-cyano-2-fluorophenoxy)ethyl]-9-oxa-3,7-diazabicyclo[3.3.1]non-3-yl]ethyl]carbamate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=872045-91-5 (retrieved 2024-04-18) (CAS RN: 872045-91-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H31FN4O4/c1-22(2,3)31-21(28)25-6-7-26-12-17-14-27(15-18(13-26)30-17)8-9-29-20-5-4-16(11-24)10-19(20)23/h4-5,10,17-18H,6-9,12-15H2,1-3H3,(H,25,28)

InChIKey

InChIKey=BLLNYXOLLAVTRF-UHFFFAOYSA-N

SMILES

C(COC1=C(F)C=C(C#N)C=C1)N2CC3OC(CN(CCNC(OC(C)(C)C)=O)C3)C2

Canonical SMILES

N#CC1=CC=C(OCCN2CC3OC(C2)CN(CCNC(=O)OC(C)(C)C)C3)C(F)=C1

Other Names for this Substance

  • Carbamic acid, N-[2-[7-[2-(4-cyano-2-fluorophenoxy)ethyl]-9-oxa-3,7-diazabicyclo[3.3.1]non-3-yl]ethyl]-, 1,1-dimethylethyl ester
  • Carbamic acid, [2-[7-[2-(4-cyano-2-fluorophenoxy)ethyl]-9-oxa-3,7-diazabicyclo[3.3.1]non-3-yl]ethyl]-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl N-[2-[7-[2-(4-cyano-2-fluorophenoxy)ethyl]-9-oxa-3,7-diazabicyclo[3.3.1]non-3-yl]ethyl]carbamate
  • [2-[7-[2-(4-Cyano-2-fluorophenoxy)ethyl]-9-oxa-3,7-diazabicyclo[3.3.1]non-3-yl]ethyl]carbamic acid tert-butyl ester
  • tert-Butyl [2-[7-[2-(4-cyano-2-fluorophenoxy)ethyl]-9-oxa-3,7-diazabicyclo[3.3.1]non-3-yl]ethyl]carbamate

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Deleted or Replaced CAS Registry Numbers

1029940-67-7

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