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Substance Name: CGS 12066B
RN: 109028-10-6
UNII: VJ9I4R0C0C
InChIKey: HTEVMLYDEWVIQE-SPIKMXEPSA-N

Note

  • CGS 12066A is the (ethanedioate (1:2))-salt.

Molecular Formula

  • C17-H17-F3-N4.2C4-H4-O4

Molecular Weight

  • 566.4865
 

Classification Codes

  • Neurotransmitter Agents
  • Serotonin Agents
  • Serotonin Receptor Agonists
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Names and Synonyms

Name of Substance

  • CGS 12066B

Synonyms

  • 7-Trifluoromethyl-4-(4-methyl-1-piperazinyl)pyrrolol(1,2-a)quinoxaline
  • CGS 12066B
  • UNII-VJ9I4R0C0C

Systematic Name

  • Pyrrolo(1,2-a)quinoxaline, 4-(4-methyl-1-piperazinyl)-7-(trifluoromethyl)-, (Z)-2-butenedioate (1:2)

Registry Numbers

CAS Registry Number

  • 109028-10-6

FDA UNII

  • VJ9I4R0C0C

System Generated Number

  • 0109028106

Molecular Formulas

Molecular Formula

  • C17-H17-F3-N4.2C4-H4-O4

Molecular Formula Fragments

  • C17-H17-F3-N4
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C17H17F3N4.2C4H4O4/c1-22-7-9-23(10-8-22)16-15-3-2-6-24(15)14-5-4-12(17(18,19)20)11-13(14)21-16;2*5-3(6)1-2-4(7)8/h2-6,11H,7-10H2,1H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-

InChIKey

HTEVMLYDEWVIQE-SPIKMXEPSA-N

Smiles

CN1CCN(CC1)c2nc3cc(ccc3n4cccc24)C(F)(F)F.OC(=O)\C=C/C(=O)O.OC(=O)\C=C/C(=O)O