4-[[[(3-Chlorophenyl)amino]carbonyl]oxy]-N,N,N-trimethyl-2-butyn-1-aminium chloride (1:1)

CAS Registry Number®

55-45-8

CAS Name

4-[[[(3-Chlorophenyl)amino]carbonyl]oxy]-N,N,N-trimethyl-2-butyn-1-aminium chloride (1:1)

Molecular Formula

C14H18ClN2O2.Cl

Cite this Page

4-[[[(3-Chlorophenyl)amino]carbonyl]oxy]-N,N,N-trimethyl-2-butyn-1-aminium chloride (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=55-45-8 (retrieved 2024-11-21) (CAS RN: 55-45-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H17ClN2O2.ClH/c1-17(2,3)9-4-5-10-19-14(18)16-13-8-6-7-12(15)11-13;/h6-8,11H,9-10H2,1-3H3;1H

InChIKey

InChIKey=CXFZFEJJLNLOTA-UHFFFAOYSA-N

SMILES

N(C(OCC#CC[N+](C)(C)C)=O)C1=CC(Cl)=CC=C1.[Cl-]

Canonical SMILES

[Cl-].O=C(OCC#CC[N+](C)(C)C)NC=1C=CC=C(Cl)C1

Other Names for this Substance

  • 2-Butyn-1-aminium, 4-[[[(3-chlorophenyl)amino]carbonyl]oxy]-N,N,N-trimethyl-, chloride (1:1)
  • Ammonium, (4-hydroxy-2-butynyl)trimethyl-, chloride, m-chlorocarbanilate
  • 2-Butyn-1-aminium, 4-[[[(3-chlorophenyl)amino]carbonyl]oxy]-N,N,N-trimethyl-, chloride
  • (4-Hydroxy-2-butynyl)trimethylammonium chloride, m-chlorocarbanilate
  • 4-[[[(3-Chlorophenyl)amino]carbonyl]oxy]-N,N,N-trimethyl-2-butyn-1-aminium chloride (1:1)

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration