Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1H-Benzimidazole, 4,5,6,7-tetrahydro-1-ethyl-5-(4-morpholinyl)-, (E)-2-butenedioate (1:3)
RN: 96224-17-8
InChIKey: ZRJLABXUWYOIPL-LDFLFNBESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H21-N3-O.3C4-H4-O4

Molecular Weight

  • 583.5437
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 4,5,6,7-Tetrahydro-1-ethyl-5-(4-morpholinyl)-1H-benzimidazole (E)-2-butenedioate (1:3)

Systematic Name

  • 1H-Benzimidazole, 4,5,6,7-tetrahydro-1-ethyl-5-(4-morpholinyl)-, (E)-2-butenedioate (1:3)

Registry Numbers

CAS Registry Number

  • 96224-17-8

System Generated Number

  • 0096224178

Molecular Formulas

Molecular Formula

  • C13-H21-N3-O.3C4-H4-O4

Molecular Formula Fragments

  • C13-H21-N3-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C13H21N3O.3C4H4O4/c1-2-15-10-14-12-9-11(3-4-13(12)15)16-5-7-17-8-6-16;3*5-3(6)1-2-4(7)8/h10-11H,2-9H2,1H3;3*1-2H,(H,5,6)(H,7,8)/b;3*2-1+

InChIKey

ZRJLABXUWYOIPL-LDFLFNBESA-N

Smiles

c1nc2c(n1CC)CCC(C2)N1CCOCC1.C(=O)(/C=C/C(=O)O)O.C(=O)(/C=C/C(=O)O)O.C(=O)(/C=C/C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 800mg/kg (800mg/kg)   Farmaco, Edizione Scientifica. Vol. 40, Pg. 818, 1985.