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Substance Name: 2(1H)-Quinolinone, 3,4-dihydro-6-(3-(3,6-dihydro-4-(2-methoxyphenyl)-1(2H)-pyridinyl)-1-propenyl)-, ethanedioate (1:1)
RN: 80834-75-9
InChIKey: BPPUPMYPJLCPEK-FXRZFVDSSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H26-N2-O2.C2-H2-O4

Molecular Weight

  • 464.5152
 
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Names and Synonyms

  • 2(1H)-Quinolinone, 3,4-dihydro-6-(3-(3,6-dihydro-4-(2-methoxyphenyl)-1(2H)-pyridinyl)-1-propenyl)-, ethanedioate (1:1)

Registry Numbers

CAS Registry Number

  • 80834-75-9

System Generated Number

  • 0080834759

Molecular Formulas

Molecular Formula

  • C24-H26-N2-O2.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C24-H26-N2-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C24H26N2O2.C2H2O4/c1-28-23-7-3-2-6-21(23)19-12-15-26(16-13-19)14-4-5-18-8-10-22-20(17-18)9-11-24(27)25-22;3-1(4)2(5)6/h2-8,10,12,17H,9,11,13-16H2,1H3,(H,25,27);(H,3,4)(H,5,6)/b5-4+;

InChIKey

BPPUPMYPJLCPEK-FXRZFVDSSA-N

Smiles

COc1ccccc1C2=CCN(CC2)C/C=C/c3ccc4c(c3)CCC(=O)N4.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 500mg/kg (500mg/kg)   United States Patent Document. Vol. #4460593,