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Substance Name: Benzoic acid, 4-(2-oxo-2-((1-(2-(1-piperidinyl)phenyl)-1-butenyl)amino)ethyl)-, (E)-
RN: 89605-74-3
InChIKey: GZVRIPWGWKOZJZ-ODCIPOBUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H28-N2-O3

Molecular Weight

  • 392.4962
 
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Names and Synonyms

Synonyms

  • (E)-4-((1-(2-Piperidinophenyl)-1-buten-1-yl)aminocarbonylmethyl)benzoic acid
  • (E)-4-(2-Oxo-2-((1-(2-(1-piperidinyl)phenyl)-1-butenyl)amino)ethyl)benzoic acid

Systematic Name

  • Benzoic acid, 4-(2-oxo-2-((1-(2-(1-piperidinyl)phenyl)-1-butenyl)amino)ethyl)-, (E)-

Registry Numbers

CAS Registry Number

  • 89605-74-3

System Generated Number

  • 0089605743

Structure Descriptors

InChI

1S/C24H28N2O3/c1-2-8-21(20-9-4-5-10-22(20)26-15-6-3-7-16-26)25-23(27)17-18-11-13-19(14-12-18)24(28)29/h4-5,8-14H,2-3,6-7,15-17H2,1H3,(H,25,27)(H,28,29)/b21-8+

InChIKey

GZVRIPWGWKOZJZ-ODCIPOBUSA-N

Smiles

CC/C=C(\c1ccccc1N2CCCCC2)/NC(=O)Cc3ccc(cc3)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 2gm/kg (2000mg/kg)   United States Patent Document. Vol. #4735959,