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Substance Name: 1H-Indole-3-acetic acid, 4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)-, methyl ester, monohydrochloride
RN: 145296-52-2
InChIKey: RTFLHZRQFKEYGI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H26-N2-O4.Cl-H

Molecular Weight

  • 370.8743
 
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Names and Synonyms

Synonym

  • 4-(2-Hydroxy-3-tert-butylaminopropoxy)indolyl-3-acetic acid methylester hydrochloride

Systematic Name

  • 1H-Indole-3-acetic acid, 4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)-, methyl ester, monohydrochloride

Registry Numbers

CAS Registry Number

  • 145296-52-2

System Generated Number

  • 0145296522

Molecular Formulas

Molecular Formula

  • C18-H26-N2-O4.Cl-H

Molecular Formula Fragments

  • C18-H26-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H26N2O4.ClH/c1-18(2,3)20-10-13(21)11-24-15-7-5-6-14-17(15)12(9-19-14)8-16(22)23-4;/h5-7,9,13,19-21H,8,10-11H2,1-4H3;1H

InChIKey

RTFLHZRQFKEYGI-UHFFFAOYSA-N

Smiles

CC(C)(C)NCC(COc1cccc2c1c(c[nH]2)CC(=O)OC)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 45mg/kg (45mg/kg)   Pharmaceutical Chemistry Journal Vol. 26, Pg. 484, 1992.
mouse LD50 oral 270mg/kg (270mg/kg)   Pharmaceutical Chemistry Journal Vol. 26, Pg. 484, 1992.