Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzeneethanamine, N-(4-(2-benzofuranyl)-1-methyl-2-pyrrolidinylidene)-3,4-dimethoxy-, (E)-2-butenedioate (1:1)
RN: 94221-95-1
InChIKey: RVBSIDCZRTWSFP-PVDHGGKCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H26-N2-O3.C4-H4-O4

Molecular Weight

  • 494.541
 
* 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

  • 1-Methyl-4-(2-benzofuryl)-2-(3',4'-dimethoxyphenethylimino)pyrrolidine hydrogen fumarate

Systematic Name

  • Benzeneethanamine, N-(4-(2-benzofuranyl)-1-methyl-2-pyrrolidinylidene)-3,4-dimethoxy-, (E)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 94221-95-1

System Generated Number

  • 0094221951

Molecular Formulas

Molecular Formula

  • C23-H26-N2-O3.C4-H4-O4

Molecular Formula Fragments

  • C23-H26-N2-O3
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C23H26N2O3.C4H4O4/c1-25-15-18(21-13-17-6-4-5-7-19(17)28-21)14-23(25)24-11-10-16-8-9-20(26-2)22(12-16)27-3;5-3(6)1-2-4(7)8/h4-9,12-13,18H,10-11,14-15H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b24-23+;2-1+

InChIKey

RVBSIDCZRTWSFP-PVDHGGKCSA-N

Smiles

c1(oc2c(c1)cccc2)C1CN(C(=N\CCc2cc(c(cc2)OC)OC)\C1)C.C(=O)(/C=C/C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 200mg/kg (200mg/kg)   United States Patent Document. Vol. #4556674,
mouse LDLo intraperitoneal 100mg/kg (100mg/kg)   United States Patent Document. Vol. #4556674,