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Substance Name: 1-Propanone, 1-((3-acetyl-4-(3-hydroxy-4-phenyl-1-piperidinyl)propoxy)phenyl)-
RN: 79010-31-4
InChIKey: JKXUXOPARUVZSV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H31-N-O4

Molecular Weight

  • 409.5229
 
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Names and Synonyms

Synonyms

  • 1-(3-Acetyl-4-((3-hydroxy-4-phenyl-1-piperidinyl)propoxy)phenyl)-1-propanone
  • BRN 4584444

Systematic Name

  • 1-Propanone, 1-((3-acetyl-4-(3-hydroxy-4-phenyl-1-piperidinyl)propoxy)phenyl)-

Registry Numbers

CAS Registry Number

  • 79010-31-4

System Generated Number

  • 0079010314

Structure Descriptors

InChI

1S/C25H31NO4/c1-3-23(28)20-10-11-24(22(18-20)19(2)27)30-17-7-14-26-15-12-25(29,13-16-26)21-8-5-4-6-9-21/h4-6,8-11,18,29H,3,7,12-17H2,1-2H3

InChIKey

JKXUXOPARUVZSV-UHFFFAOYSA-N

Smiles

CCC(=O)c1ccc(c(c1)C(=O)C)OCCCN2CCC(CC2)(c3ccccc3)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 20, Pg. 480, 1981.