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Substance Name: Benzenebutanamide, N-(2-(3,4-dimethoxyphenyl)ethyl)-4-fluoro-gammma-oxo-
RN: 56743-01-2
InChIKey: RMDZNRQNUQWVNJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H22-F-N-O4

Molecular Weight

  • 359.3948
 
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Names and Synonyms

Synonyms

  • BRN 2173332
  • N-(2-(3,4-Dimethoxyphenyl)ethyl)-4-fluoro-gamma-oxobenzenebutanamide

Systematic Name

  • Benzenebutanamide, N-(2-(3,4-dimethoxyphenyl)ethyl)-4-fluoro-gammma-oxo-

Registry Numbers

CAS Registry Number

  • 56743-01-2

System Generated Number

  • 0056743012

Structure Descriptors

InChI

1S/C20H22FNO4/c1-25-18-9-3-14(13-19(18)26-2)11-12-22-20(24)10-8-17(23)15-4-6-16(21)7-5-15/h3-7,9,13H,8,10-12H2,1-2H3,(H,22,24)

InChIKey

RMDZNRQNUQWVNJ-UHFFFAOYSA-N

Smiles

COc1ccc(cc1OC)CCNC(=O)CCC(=O)c2ccc(cc2)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 2500mg/kg (2500mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 40, Pg. 1218, 1975.