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Substance Name: Benzoic acid, 4-(2-(((4-chlorophenyl)(2-(1-piperidinyl)phenyl)methyl)amino)-2-oxoethyl)-
RN: 89573-07-9
InChIKey: PHCBSBUTMGVSJN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H27-Cl-N2-O3

Molecular Weight

  • 462.9743
 
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Names and Synonyms

Synonyms

  • 4-((alpha-(4-Chlorophenyl)-2-piperidinobenzyl)aminocarbonylmethyl)benzoic acid
  • 4-(2-(((4-Chlorophenyl)(2-(1-piperidinyl)phenyl)methyl)amino)-2-oxoethyl)benzoic acid

Systematic Name

  • Benzoic acid, 4-(2-(((4-chlorophenyl)(2-(1-piperidinyl)phenyl)methyl)amino)-2-oxoethyl)-

Registry Numbers

CAS Registry Number

  • 89573-07-9

System Generated Number

  • 0089573079

Structure Descriptors

InChI

1S/C27H27ClN2O3/c28-22-14-12-20(13-15-22)26(23-6-2-3-7-24(23)30-16-4-1-5-17-30)29-25(31)18-19-8-10-21(11-9-19)27(32)33/h2-3,6-15,26H,1,4-5,16-18H2,(H,29,31)(H,32,33)

InChIKey

PHCBSBUTMGVSJN-UHFFFAOYSA-N

Smiles

c1ccc(c(c1)C(c2ccc(cc2)Cl)NC(=O)Cc3ccc(cc3)C(=O)O)N4CCCCC4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4735959,