1H-Indole-3-ethanaminium, α-carboxy-N,N,N-trimethyl-, chloride, (S)-

CAS Registry Number®

20671-76-5

CAS Name

1H-Indole-3-ethanaminium, α-carboxy-N,N,N-trimethyl-, chloride, (S)-

Molecular Formula

C14H19N2O2.Cl

Cite this Page

1H-Indole-3-ethanaminium, α-carboxy-N,N,N-trimethyl-, chloride, (S)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=20671-76-5 (retrieved 2024-12-23) (CAS RN: 20671-76-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    231-232 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C14H18N2O2.ClH/c1-16(2,3)13(14(17)18)8-10-9-15-12-7-5-4-6-11(10)12;/h4-7,9,13,15H,8H2,1-3H3;1H/t13-;/m0./s1

InChIKey

InChIKey=NZXZRRFENSICAK-ZOWNYOTGSA-N

SMILES

C([C@H]([N@+](C)(C)C)C(O)=O)C=1C=2C(NC1)=CC=CC2.[Cl-]

Canonical SMILES

[Cl-].O=C(O)C(CC1=CNC=2C=CC=CC21)[N+](C)(C)C

Other Names for this Substance

  • 1H-Indole-3-ethanaminium, α-carboxy-N,N,N-trimethyl-, chloride, (S)-
  • Ammonium, (1-carboxy-2-indol-3-ylethyl)trimethyl-, chloride
  • Hypaphorine hydrochloride

Deleted or Replaced CAS Registry Numbers

5979-03-3

CAS INSIGHTSTM
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