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Substance Name: 4H-1-Benzopyran-8-carboxylic acid, 3-methyl-4-oxo-2-phenyl-, 3-(diethylamino)propyl ester, hydrochloride
RN: 3468-08-4
InChIKey: QESDLTIZNFEOMN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H27-N-O4.Cl-H

Molecular Weight

  • 429.941
 
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Names and Synonyms

Synonym

  • REC 1-0473

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 3468-08-4

System Generated Number

  • 0003468084

Molecular Formulas

Molecular Formula

  • C24-H27-N-O4.Cl-H

Molecular Formula Fragments

  • C24-H27-N-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C24H27NO4.ClH/c1-4-25(5-2)15-10-16-28-24(27)20-14-9-13-19-21(26)17(3)22(29-23(19)20)18-11-7-6-8-12-18;/h6-9,11-14H,4-5,10,15-16H2,1-3H3;1H

InChIKey

QESDLTIZNFEOMN-UHFFFAOYSA-N

Smiles

c12c(c(c(C)c(o2)c2ccccc2)=O)cccc1C(OCCC[NH+](CC)CC)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 intraperitoneal 200mg/kg (200mg/kg)   Journal of Medicinal and Pharmaceutical Chemistry. Vol. 2, Pg. 263, 1960.