Bethanechol

CAS Registry Number®

674-38-4

CAS Name

Bethanechol

Molecular Formula

C7H17N2O2

Cite this Page

Bethanechol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=674-38-4 (retrieved 2024-11-22) (CAS RN: 674-38-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C7H16N2O2/c1-6(11-7(8)10)5-9(2,3)4/h6H,5H2,1-4H3,(H-,8,10)/p+1

InChIKey

InChIKey=NZUPCNDJBJXXRF-UHFFFAOYSA-O

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 1-Propanaminium, 2-[(aminocarbonyl)oxy]-N,N,N-trimethyl-
  • Ammonium, (2-hydroxypropyl)trimethyl-, carbamate (ester)
  • 2-[(Aminocarbonyl)oxy]-N,N,N-trimethyl-1-propanaminium
  • Bethanechol
  • Carbamoyl-β-methylcholine

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Deleted or Replaced CAS Registry Numbers

111318-31-1, 91609-06-2

CAS INSIGHTSTM
Targeted protein degrader structure, illustration