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Substance Name: Quinoline, 2-(4-ethyl-1-piperazinyl)-4-phenyl-, (Z)-2-butenedioate (1:2)
RN: 94788-64-4
InChIKey: DNWUTDTYCVGVPV-LVEZLNDCSA-N

Molecular Formula

  • C21-H23-N3.2C4-H4-O4

Molecular Weight

  • 549.577
 
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Names and Synonyms

Synonyms

  • 2-(4-Ethyl-1-piperazinyl)-4-phenylquinoline (Z)-2-butenedioate (1:2)
  • 2-(4-Ethyl-1-piperazinyl)-4-phenylquinoline dimaleate

Systematic Name

  • Quinoline, 2-(4-ethyl-1-piperazinyl)-4-phenyl-, (Z)-2-butenedioate (1:2)

Registry Numbers

CAS Registry Number

  • 94788-64-4

Related Registry Number

  • 72320-59-3 (Parent)

System Generated Number

  • 0094788644

Molecular Formulas

Molecular Formula

  • C21-H23-N3.2C4-H4-O4

Molecular Formula Fragments

  • C21-H23-N3
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C21H23N3.2C4H4O4/c1-2-23-12-14-24(15-13-23)21-16-19(17-8-4-3-5-9-17)18-10-6-7-11-20(18)22-21;2*5-3(6)1-2-4(7)8/h3-11,16H,2,12-15H2,1H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+

InChIKey

DNWUTDTYCVGVPV-LVEZLNDCSA-N

Smiles

n1c(N2CCN(CC2)CC)cc(c2ccccc12)c1ccccc1.C(\C=C\C(=O)O)(=O)O.C(\C=C\C(=O)O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1200mg/kg (1200mg/kg)   United States Patent Document. Vol. #4677107,
rat LD50 oral 3600mg/kg (3600mg/kg)   United States Patent Document. Vol. #4677107,