Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Pyrrolidine, 1-(5-(1,3-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl)-
RN: 54976-54-4
InChIKey: GQIJYUMTOUBHSH-IJIVKGSJSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H17-N-O3

Molecular Weight

  • 271.3143
 
* 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-(5-(1,3-Benzodioxol-5-yl)-1-oxo-2,4-pentadienyl)pyrrolidine

Systematic Name

  • Pyrrolidine, 1-(5-(1,3-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl)-

Registry Numbers

CAS Registry Number

  • 54976-54-4

System Generated Number

  • 0054976544

Structure Descriptors

InChI

1S/C16H17NO3/c18-16(17-9-3-4-10-17)6-2-1-5-13-7-8-14-15(11-13)20-12-19-14/h1-2,5-8,11H,3-4,9-10,12H2/b5-1+,6-2+

InChIKey

GQIJYUMTOUBHSH-IJIVKGSJSA-N

Smiles

c1cc2c(cc1/C=C/C=C/C(=O)N3CCCC3)OCO2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 760mg/kg (760mg/kg)   Yakhak Hoe Chi. Journal of the Pharmaceutical Society. Vol. 30, Pg. 163, 1986.