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Substance Name: 1-Butylamine, N-methyl-N-(3-(p-(phenoxymethyl)phenyl)propyl)-
RN: 100482-75-5
InChIKey: XHTNRBBPTQXREP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H29-N-O

Molecular Weight

  • 311.4661
 
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Names and Synonyms

Synonyms

  • 4-13-00-01966 (Beilstein Handbook Reference)
  • BRN 3397630
  • N-Methyl-N-(3-(p-(phenoxymethyl)phenyl)propyl)-1-butylamine

Systematic Name

  • 1-Butylamine, N-methyl-N-(3-(p-(phenoxymethyl)phenyl)propyl)-

Registry Numbers

CAS Registry Number

  • 100482-75-5

System Generated Number

  • 0100482755

Structure Descriptors

InChI

1S/C21H29NO/c1-3-4-16-22(2)17-8-9-19-12-14-20(15-13-19)18-23-21-10-6-5-7-11-21/h5-7,10-15H,3-4,8-9,16-18H2,1-2H3

InChIKey

XHTNRBBPTQXREP-UHFFFAOYSA-N

Smiles

CCCCN(C)CCCc1ccc(cc1)COc2ccccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 30mg/kg (30mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 9, Pg. 313, 1959.