3,5,7-Triaza-1-azoniatricyclo[3.3.1.13,7]decane, 1-[2-(3-chloro-2-thienyl)-2-oxoethyl]-, bromide (1:1)

CAS Registry Number®

477709-00-5
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CAS Name

3,5,7-Triaza-1-azoniatricyclo[3.3.1.13,7]decane, 1-[2-(3-chloro-2-thienyl)-2-oxoethyl]-, bromide (1:1)

Molecular Formula

C12H16ClN4OS.Br

Cite this Page

3,5,7-Triaza-1-azoniatricyclo[3.3.1.13,7]decane, 1-[2-(3-chloro-2-thienyl)-2-oxoethyl]-, bromide (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=477709-00-5 (retrieved 2024-07-07) (CAS RN: 477709-00-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H16ClN4OS.BrH/c13-10-1-2-19-12(10)11(18)3-17-7-14-4-15(8-17)6-16(5-14)9-17;/h1-2H,3-9H2;1H/q+1;/p-1

InChIKey

InChIKey=UGIUCLHBIHOVPF-UHFFFAOYSA-M

SMILES

C(C(=O)C1=C(Cl)C=CS1)[N+]23CN4CN(C2)CN(C3)C4.[Br-]

Canonical SMILES

[Br-].O=C(C=1SC=CC1Cl)C[N+]23CN4CN(CN(C4)C2)C3

Other Names for this Substance

  • 3,5,7-Triaza-1-azoniatricyclo[3.3.1.13,7]decane, 1-[2-(3-chloro-2-thienyl)-2-oxoethyl]-, bromide (1:1)
  • 3,5,7-Triaza-1-azoniatricyclo[3.3.1.13,7]decane, 1-[2-(3-chloro-2-thienyl)-2-oxoethyl]-, bromide