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Substance Name: Benzenepropanol, alpha-(3,6-dimethoxy-2-(2-(1-piperidinyl)ethoxy)phenyl)-4-fluoro-
RN: 88772-47-8
InChIKey: WRJRAFPXDHDMBA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H32-F-N-O4

Molecular Weight

  • 417.5178
 
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Names and Synonyms

Synonym

  • alpha-(3,6-Dimethoxy-2-(2-(1-piperidinyl)ethoxy)phenyl)-4-fluorobenzenepropanol

Systematic Name

  • Benzenepropanol, alpha-(3,6-dimethoxy-2-(2-(1-piperidinyl)ethoxy)phenyl)-4-fluoro-

Registry Numbers

CAS Registry Number

  • 88772-47-8

System Generated Number

  • 0088772478

Structure Descriptors

InChI

1S/C24H32FNO4/c1-28-21-12-13-22(29-2)24(30-17-16-26-14-4-3-5-15-26)23(21)20(27)11-8-18-6-9-19(25)10-7-18/h6-7,9-10,12-13,20,27H,3-5,8,11,14-17H2,1-2H3

InChIKey

WRJRAFPXDHDMBA-UHFFFAOYSA-N

Smiles

c1(c(c(ccc1OC)OC)OCCN1CCCCC1)C(CCc1ccc(F)cc1)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 31mg/kg (31mg/kg)   United States Patent Document. Vol. #4732896,