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Substance Name: 4H-1-Benzopyran-8-carboxylic acid, 3-methyl-4-oxo-2-phenyl-, 3-(2-methyl-1-piperidinyl)propyl ester, hydrochloride, hydrate
RN: 86433-33-2
InChIKey: RJFNAVZRPRUWIJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H29-N-O4.Cl-H.H2-O

Molecular Weight

  • 455.979
 
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Names and Synonyms

Synonym

  • 3-(2-Methyl-N-piperidino)propyl 3-methylflavone-8-carboxylate hydrochloride hydrate

Systematic Name

  • 4H-1-Benzopyran-8-carboxylic acid, 3-methyl-4-oxo-2-phenyl-, 3-(2-methyl-1-piperidinyl)propyl ester, hydrochloride, hydrate

Registry Numbers

CAS Registry Number

  • 86433-33-2

System Generated Number

  • 0086433332

Molecular Formulas

Molecular Formula

  • C26-H29-N-O4.Cl-H.H2-O

Molecular Formula Fragments

  • C26-H29-N-O4
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C26H29NO4.ClH/c1-18-10-6-7-15-27(18)16-9-17-30-26(29)22-14-8-13-21-23(28)19(2)24(31-25(21)22)20-11-4-3-5-12-20;/h3-5,8,11-14,18H,6-7,9-10,15-17H2,1-2H3;1H

InChIKey

RJFNAVZRPRUWIJ-UHFFFAOYSA-N

Smiles

Cc1c(=O)c2cccc(c2oc1c3ccccc3)C(=O)OCCCN4CCCCC4C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 265mg/kg (265mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 43, Pg. 28, 1993.
mouse LD50 oral 882mg/kg (882mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 43, Pg. 28, 1993.