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Substance Name: 2,4,6-Cycloheptatriene-1-acetic acid, 3-morpholinopropyl ester, hydrochloride
RN: 69352-80-3
InChIKey: OHYVOJTVINKOPB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H23-N-O3.Cl-H

Molecular Weight

  • 313.823
 
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Names and Synonyms

Synonym

  • MP 45

Systematic Name

  • 2,4,6-Cycloheptatriene-1-acetic acid, 3-morpholinopropyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 69352-80-3

System Generated Number

  • 0069352803

Molecular Formulas

Molecular Formula

  • C16-H23-N-O3.Cl-H

Molecular Formula Fragments

  • C16-H23-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H23NO3.ClH/c18-16(14-15-6-3-1-2-4-7-15)20-11-5-8-17-9-12-19-13-10-17;/h1-4,6-7,15H,5,8-14H2;1H

InChIKey

OHYVOJTVINKOPB-UHFFFAOYSA-N

Smiles

C1(CC(OCCC[NH+]2CCOCC2)=O)C=CC=CC=C1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1500mg/kg (1500mg/kg)   Chimica Therapeutica. Vol. 7, Pg. 407, 1972.