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Substance Name: 1H-Indole, 4-(1,2,5,6-tetrahydro-1-propyl-3-pyridinyl)-, (E)-2-butenedioate (1:1)
RN: 77801-73-1
InChIKey: QIUWGXFVTSBEMO-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H20-N2.C4-H4-O4

Molecular Weight

  • 356.4196
 
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Names and Synonyms

Synonyms

  • 4-(1,2,5,6-Tetrahydro-1-propyl-3-pyridinyl)-1H-indole (E)-2-butenedioate (1:1)
  • 4-(1-Propyl-1,2,5,6-tetrahydropyridin-3-yl)-1H-indole fumarate

Systematic Name

  • 1H-Indole, 4-(1,2,5,6-tetrahydro-1-propyl-3-pyridinyl)-, (E)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 77801-73-1

System Generated Number

  • 0077801731

Molecular Formulas

Molecular Formula

  • C16-H20-N2.C4-H4-O4

Molecular Formula Fragments

  • C16-H20-N2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C16H20N2.C4H4O4/c1-2-10-18-11-4-5-13(12-18)14-6-3-7-16-15(14)8-9-17-16;5-3(6)1-2-4(7)8/h3,5-9,17H,2,4,10-12H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

QIUWGXFVTSBEMO-WLHGVMLRSA-N

Smiles

CCCN1CCC=C(C1)c2cccc3c2cc[nH]3.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 80mg/kg (80mg/kg)   United States Patent Document. Vol. #4332808,