Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Cyclopentanecarboxylic acid, 3-(((2,6-dimethylphenyl)amino)carbonyl)-1,2,2-trimethyl-, monosodium salt, (1R-cis)-
RN: 67814-70-4
InChIKey: KHNKUOKMYQEGLR-WJKBNZMCSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H24-N-O3.Na

Molecular Weight

  • 325.3816
 
* 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

  • Cyclopentanecarboxylic acid, 3-(((2,6-dimethylphenyl)amino)carbonyl)-1,2,2-trimethyl-, monosodium salt, (1R-cis)-

Registry Numbers

CAS Registry Number

  • 67814-70-4

System Generated Number

  • 0067814704

Molecular Formulas

Molecular Formula

  • C18-H24-N-O3.Na

Molecular Formula Fragments

  • C18-H24-N-O3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C18H25NO3.Na/c1-11-7-6-8-12(2)14(11)19-15(20)13-9-10-18(5,16(21)22)17(13,3)4;/h6-8,13H,9-10H2,1-5H3,(H,19,20)(H,21,22);/q;+1/p-1/t13-,18+;/m1./s1

InChIKey

KHNKUOKMYQEGLR-WJKBNZMCSA-M

Smiles

Cc1cccc(c1NC(=O)[C@H]2CC[C@@](C2(C)C)(C)C(=O)[O-])C.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2227mg/kg (2227mg/kg)   German Offenlegungsschrift Patent Document. Vol. #2659052,