Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1H-Cyclohepta(b)pyridine-1-propanamide, decahydro-N-(2,6-dimethylphenyl)-, trans-, ethanedioate (1:1)
RN: 41920-88-1
InChIKey: MAARURXHSNUCAD-VOMIJIAVSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H32-N2-O.C2-H2-O4

Molecular Weight

  • 418.5306
 
* 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

  • 1H-Cyclohepta(b)pyridine-1-propanamide, decahydro-N-(2,6-dimethylphenyl)-, trans-, ethanedioate (1:1)

Registry Numbers

CAS Registry Number

  • 41920-88-1

System Generated Number

  • 0041920881

Molecular Formulas

Molecular Formula

  • C21-H32-N2-O.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C21-H32-N2-O
  • COMPONENT

Structure Descriptors

InChI

1S/C21H32N2O.C2H2O4/c1-16-8-6-9-17(2)21(16)22-20(24)13-15-23-14-7-11-18-10-4-3-5-12-19(18)23;3-1(4)2(5)6/h6,8-9,18-19H,3-5,7,10-15H2,1-2H3,(H,22,24);(H,3,4)(H,5,6)/t18-,19+;/m1./s1

InChIKey

MAARURXHSNUCAD-VOMIJIAVSA-N

Smiles

Cc1cccc(c1NC(=O)CCN2CCC[C@@H]3[C@@H]2CCCCC3)C.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD intravenous > 400mg/kg (400mg/kg)   Journal of Medicinal Chemistry. Vol. 16, Pg. 394, 1973.