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Substance Name: SR 44538A
RN: 119585-16-9
InChIKey: WBIBTRZOFHAEKB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C33-H35-N-O2.Cl-H

Molecular Weight

  • 514.1054
 
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Names and Synonyms

Results Name

  • SR 44538A

Synonyms

  • beta-1-Naphthalenyl-4-(phenylmethyl)-1-piperidinebutanol benzoate (ester) hydrochloride
  • SR 44538 A

Systematic Name

  • 1-Piperidinebutanol, beta-1-naphthalenyl-4-(phenylmethyl)-, benzoate (ester), hydrochloride

Registry Numbers

CAS Registry Number

  • 119585-16-9

System Generated Number

  • 0119585169

Molecular Formulas

Molecular Formula

  • C33-H35-N-O2.Cl-H

Molecular Formula Fragments

  • C33-H35-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C33H35NO2.ClH/c35-33(29-13-5-2-6-14-29)36-25-30(32-17-9-15-28-12-7-8-16-31(28)32)20-23-34-21-18-27(19-22-34)24-26-10-3-1-4-11-26;/h1-17,27,30H,18-25H2;1H

InChIKey

WBIBTRZOFHAEKB-UHFFFAOYSA-N

Smiles

c1ccc(cc1)CC2CCN(CC2)CCC(COC(=O)c3ccccc3)c4cccc5c4cccc5.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #5089251,