(+)-Hypaphorine

CAS Registry Number®

487-58-1
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CAS Name

(+)-Hypaphorine

Molecular Formula

C14H18N2O2

Cite this Page

(+)-Hypaphorine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=487-58-1 (retrieved 2024-04-27) (CAS RN: 487-58-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H18N2O2/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/t13-/m0/s1

InChIKey

InChIKey=AOHCBEAZXHZMOR-ZDUSSCGKSA-N

SMILES

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

Canonical SMILES

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-, inner salt, (αS)-
  • Hypaphorine
  • Ammonium, (1-carboxy-2-indol-3-ylethyl)trimethyl-, hydroxide, inner salt
  • 1H-Indole-3-ethanaminium, α-carboxy-N,N,N-trimethyl-, inner salt, (S)-
  • (1-Carboxy-2-indol-3-ylethyl)trimethylammonium hydroxide, inner salt

Deleted or Replaced CAS Registry Numbers

97045-39-1, 12673-47-1, 63767-89-5

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