1H-Indole-3-ethanaminium, N,N,N-trimethyl-4-(phosphonooxy)-, inner salt

CAS Registry Number®

114264-95-8
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CAS Name

1H-Indole-3-ethanaminium, N,N,N-trimethyl-4-(phosphonooxy)-, inner salt

Molecular Formula

C13H19N2O4P

Cite this Page

1H-Indole-3-ethanaminium, N,N,N-trimethyl-4-(phosphonooxy)-, inner salt.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=114264-95-8 (retrieved 2024-04-25) (CAS RN: 114264-95-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    176-178 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H19N2O4P/c1-15(2,3)8-7-10-9-14-11-5-4-6-12(13(10)11)19-20(16,17)18/h4-6,9,14H,7-8H2,1-3H3,(H-,16,17,18)

InChIKey

InChIKey=OIIPFLWAQQNCHA-UHFFFAOYSA-N

SMILES

C(C[N+](C)(C)C)C=1C=2C(NC1)=CC=CC2OP(=O)([O-])O

Canonical SMILES

O=P([O-])(O)OC1=CC=CC=2NC=C(C12)CC[N+](C)(C)C

Other Names for this Substance

  • 1H-Indole-3-ethanaminium, N,N,N-trimethyl-4-(phosphonooxy)-, inner salt
  • Aeruginascin
  • Aeruginascine

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