3H-Indolium, 1-(5-carboxypentyl)-2,3,3-trimethyl-, bromide (1:1)

CAS Registry Number®

171429-43-9

CAS Name

3H-Indolium, 1-(5-carboxypentyl)-2,3,3-trimethyl-, bromide (1:1)

Molecular Formula

C17H24NO2.Br

Cite this Page

3H-Indolium, 1-(5-carboxypentyl)-2,3,3-trimethyl-, bromide (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=171429-43-9 (retrieved 2024-11-24) (CAS RN: 171429-43-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H23NO2.BrH/c1-13-17(2,3)14-9-6-7-10-15(14)18(13)12-8-4-5-11-16(19)20;/h6-7,9-10H,4-5,8,11-12H2,1-3H3;1H

InChIKey

InChIKey=YUUDHAOMIPLRQU-UHFFFAOYSA-N

SMILES

C(CCCCC(O)=O)[N+]=1C=2C(C(C)(C)C1C)=CC=CC2.[Br-]

Canonical SMILES

[Br-].O=C(O)CCCCC[N+]=1C=2C=CC=CC2C(C1C)(C)C

Other Names for this Substance

  • 3H-Indolium, 1-(5-carboxypentyl)-2,3,3-trimethyl-, bromide (1:1)
  • 3H-Indolium, 1-(5-carboxypentyl)-2,3,3-trimethyl-, bromide
  • 1-(5-Carboxypentyl)-2,3,3-trimethylindolium bromide
  • 1-(5-Carboxypentyl)-2,3,3-trimethylindoleninium bromide
  • 1-(5-Carboxypentyl)-2,3,3-trimethyl-3H-indolium bromide

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