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Substance Name: 2(1H)-Quinolinone, 3,4-dihydro-6-(3-(4-(3-methylphenyl)-1-piperazinyl)-1-propenyl)-1-(phenylmethyl)-, ethanedioate (1:1)
RN: 80834-68-0
InChIKey: FDMPNKGQKVQEBJ-AAGWESIMSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H33-N3-O.C2-H2-O4

Molecular Weight

  • 541.6445
 
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Names and Synonyms

Synonym

  • 1-Benzyl-6-(3-(4-(3-methylphenyl)-1-piperazinyl)-1-propenyl)-3,4-dihydrocarbostyril oxalate

Systematic Name

  • 2(1H)-Quinolinone, 3,4-dihydro-6-(3-(4-(3-methylphenyl)-1-piperazinyl)-1-propenyl)-1-(phenylmethyl)-, ethanedioate (1:1)

Registry Numbers

CAS Registry Number

  • 80834-68-0

System Generated Number

  • 0080834680

Molecular Formulas

Molecular Formula

  • C30-H33-N3-O.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C30-H33-N3-O
  • COMPONENT

Structure Descriptors

InChI

1S/C30H33N3O.C2H2O4/c1-24-7-5-11-28(21-24)32-19-17-31(18-20-32)16-6-10-25-12-14-29-27(22-25)13-15-30(34)33(29)23-26-8-3-2-4-9-26;3-1(4)2(5)6/h2-12,14,21-22H,13,15-20,23H2,1H3;(H,3,4)(H,5,6)/b10-6+;

InChIKey

FDMPNKGQKVQEBJ-AAGWESIMSA-N

Smiles

Cc1cccc(c1)N2CCN(CC2)C/C=C/c3ccc4c(c3)CCC(=O)N4Cc5ccccc5.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,