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Substance Name: Acetic acid, (4-(2-(((4-chlorophenyl)sulfonyl)oxy)ethyl)-2-((4-(4-phenylbutoxy)benzoyl)amino)phenoxy)-
RN: 139579-76-3
InChIKey: IEKGWEXVPPMDGZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C33-H32-Cl-N-O8-S

Molecular Weight

  • 638.1338
 
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Names and Synonyms

  • Acetic acid, (4-(2-(((4-chlorophenyl)sulfonyl)oxy)ethyl)-2-((4-(4-phenoxybutoxy)benzoyl)amino)phenoxy)-
  • Acetic acid, (4-(2-(((4-chlorophenyl)sulfonyl)oxy)ethyl)-2-((4-(4-phenylbutoxy)benzoyl)amino)phenoxy)-

Registry Numbers

CAS Registry Number

  • 139579-76-3

System Generated Number

  • 0139579763

Structure Descriptors

InChI

1S/C33H32ClNO8S/c34-27-12-16-29(17-13-27)44(39,40)43-21-19-25-9-18-31(42-23-32(36)37)30(22-25)35-33(38)26-10-14-28(15-11-26)41-20-5-4-8-24-6-2-1-3-7-24/h1-3,6-7,9-18,22H,4-5,8,19-21,23H2,(H,35,38)(H,36,37)

InChIKey

IEKGWEXVPPMDGZ-UHFFFAOYSA-N

Smiles

c1ccc(cc1)CCCCOc2ccc(cc2)C(=O)Nc3cc(ccc3OCC(=O)O)CCOS(=O)(=O)c4ccc(cc4)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 300mg/kg (300mg/kg)   Japanese Kokai Tokyo Koho Patents. Vol. #91-258759,