Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benexate [INN]
RN: 78718-52-2
UNII: O3PR2X907M
InChIKey: IAXUQWSLRKIRFR-SAABIXHNSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H27-N3-O4

Molecular Weight

  • 409.4833
 
* 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

Name of Substance

  • Benexate
  • Benexate [INN]

Synonyms

  • Benexate
  • Benexato
  • Benexato [Spanish]
  • Benexatum
  • Benexatum [Latin]
  • UNII-O3PR2X907M

Systematic Names

  • Benzoic acid, 2-(((4-(((aminoiminomethyl)amino)methyl)cyclohexyl)carbonyl)oxy)-, phenylmethyl ester, trans-
  • Benzyl salicylate, trans-4-(guanidinomethyl)cyclohexanecarboxylate

Registry Numbers

CAS Registry Number

  • 78718-52-2

FDA UNII

  • O3PR2X907M

System Generated Number

  • 0078718522

Structure Descriptors

InChI

1S/C23H27N3O4/c24-23(25)26-14-16-10-12-18(13-11-16)21(27)30-20-9-5-4-8-19(20)22(28)29-15-17-6-2-1-3-7-17/h1-9,16,18H,10-15H2,(H4,24,25,26)/t16-,18-

InChIKey

IAXUQWSLRKIRFR-SAABIXHNSA-N

Smiles

NC(=N)NC[C@@H]1CC[C@H](CC1)C(=O)Oc2ccccc2C(=O)OCc3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 7600mg/kg (7600mg/kg)   Japanese Kokai Tokyo Koho Patents. Vol. #91-90017,
rat LD50 oral 8010mg/kg (8010mg/kg)   Japanese Kokai Tokyo Koho Patents. Vol. #91-90017,