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Substance Name: Undecanoic acid, 11-(((2-benzoyl-4-chlorophenyl)sulfonyl)amino)-
RN: 111855-65-3
InChIKey: QPBVNXQLWDMODP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H30-Cl-N-O5-S

Molecular Weight

  • 480.022
 
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Names and Synonyms

Synonyms

  • 11-(((2-Benzoyl-4-chlorophenyl)sulfonyl)amino)undecanoic acid
  • 11-(2-Benzoyl-4-chlorobenzenesulphonamido)undecanoic acid

Systematic Name

  • Undecanoic acid, 11-(((2-benzoyl-4-chlorophenyl)sulfonyl)amino)-

Registry Numbers

CAS Registry Number

  • 111855-65-3

System Generated Number

  • 0111855653

Structure Descriptors

InChI

1S/C24H30ClNO5S/c25-20-15-16-22(21(18-20)24(29)19-12-8-7-9-13-19)32(30,31)26-17-11-6-4-2-1-3-5-10-14-23(27)28/h7-9,12-13,15-16,18,26H,1-6,10-11,14,17H2,(H,27,28)

InChIKey

QPBVNXQLWDMODP-UHFFFAOYSA-N

Smiles

c1ccc(cc1)C(=O)c2cc(ccc2S(=O)(=O)NCCCCCCCCCCC(=O)O)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1600mg/kg (1600mg/kg)   United States Patent Document. Vol. #4980349,
rat LD50 oral > 800mg/kg (800mg/kg)   United States Patent Document. Vol. #4980349,