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Substance Name: Indole-3-carboxylic acid, 5-hydroxy-2-((4-methyl-1-piperazinyl)methyl)-1-phenyl-, ethyl ester, p-toluenesulfonate (ester), hydrochloride
RN: 88461-84-1
InChIKey: ANPOJYICGPJFKJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H33-N3-O5-S.Cl-H

Molecular Weight

  • 584.134
 
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Names and Synonyms

  • Indole-3-carboxylic acid, 5-hydroxy-2-((4-methyl-1-piperazinyl)methyl)-1-phenyl-, ethyl ester, p-toluenesulfonate (ester), hydrochloride

Registry Numbers

CAS Registry Number

  • 88461-84-1

System Generated Number

  • 0088461841

Molecular Formulas

Molecular Formula

  • C30-H33-N3-O5-S.Cl-H

Molecular Formula Fragments

  • C30-H33-N3-O5-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C30H33N3O5S.ClH/c1-4-37-30(34)29-26-20-24(38-39(35,36)25-13-10-22(2)11-14-25)12-15-27(26)33(23-8-6-5-7-9-23)28(29)21-32-18-16-31(3)17-19-32;/h5-15,20H,4,16-19,21H2,1-3H3;1H

InChIKey

ANPOJYICGPJFKJ-UHFFFAOYSA-N

Smiles

c1(n(c2ccc(cc2c1C(OCC)=O)OS(c1ccc(C)cc1)(=O)=O)c1ccccc1)C[NH+]1CCN(C)CC1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD16 oral 1gm/kg (1000mg/kg)   Russian Pharmacology and Toxicology Vol. 46, Pg. 223, 1983.