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Substance Name: 2-Pyrrolidinone, 5-(hexyloxy)-1-(phenylsulfonyl)-
RN: 111711-89-8
InChIKey: GYYBSXFRNPEHGE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H23-N-O4-S

Molecular Weight

  • 325.4267
 
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Names and Synonyms

Synonyms

  • 5-(Hexyloxy)-1-(phenylsulfonyl)-2-pyrrolidinone
  • BRN 4758405

Systematic Name

  • 2-Pyrrolidinone, 5-(hexyloxy)-1-(phenylsulfonyl)-

Registry Numbers

CAS Registry Number

  • 111711-89-8

System Generated Number

  • 0111711898

Structure Descriptors

InChI

1S/C16H23NO4S/c1-2-3-4-8-13-21-16-12-11-15(18)17(16)22(19,20)14-9-6-5-7-10-14/h5-7,9-10,16H,2-4,8,11-13H2,1H3

InChIKey

GYYBSXFRNPEHGE-UHFFFAOYSA-N

Smiles

CCCCCCOC1CCC(=O)N1S(=O)(=O)c2ccccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 26, Pg. 403, 1991.