3-Carboxy-N,N,N-trimethyl-2-[(1-oxohexyl)oxy]-1-propanaminium

CAS Registry Number®

10331-23-4

CAS Name

3-Carboxy-N,N,N-trimethyl-2-[(1-oxohexyl)oxy]-1-propanaminium

Molecular Formula

C13H26NO4

Cite this Page

3-Carboxy-N,N,N-trimethyl-2-[(1-oxohexyl)oxy]-1-propanaminium.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=10331-23-4 (retrieved 2024-11-22) (CAS RN: 10331-23-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H25NO4/c1-5-6-7-8-13(17)18-11(9-12(15)16)10-14(2,3)4/h11H,5-10H2,1-4H3/p+1

InChIKey

InChIKey=VVPRQWTYSNDTEA-UHFFFAOYSA-O

SMILES

C(OC(CCCCC)=O)(C[N+](C)(C)C)CC(O)=O

Canonical SMILES

O=C(O)CC(OC(=O)CCCCC)C[N+](C)(C)C

Other Names for this Substance

  • 1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-[(1-oxohexyl)oxy]-
  • Ammonium, (3-carboxy-2-hydroxypropyl)trimethyl-, hexanoate (ester)
  • 3-Carboxy-N,N,N-trimethyl-2-[(1-oxohexyl)oxy]-1-propanaminium

Deleted or Replaced CAS Registry Numbers

45215-17-6

CAS INSIGHTSTM
Targeted protein degrader structure, illustration