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Substance Name: p-Cymene-2-carboxylic acid, 3-(2-hydroxy-3-(isopropylamino)propoxy)-, isopropyl ester
RN: 53251-83-5
InChIKey: RUOFYGLAOTYOFP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H33-N-O4

Molecular Weight

  • 351.484
 
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Names and Synonyms

Synonyms

  • BRN 2757663
  • Isopropyl 3-(2-hydroxy-3-(isopropylamino)propoxy)-p-cymene-2-carboxylate

Systematic Name

  • p-Cymene-2-carboxylic acid, 3-(2-hydroxy-3-(isopropylamino)propoxy)-, isopropyl ester

Registry Numbers

CAS Registry Number

  • 53251-83-5

System Generated Number

  • 0053251835

Structure Descriptors

InChI

1S/C20H33NO4/c1-12(2)17-9-8-15(7)18(20(23)25-14(5)6)19(17)24-11-16(22)10-21-13(3)4/h8-9,12-14,16,21-22H,10-11H2,1-7H3

InChIKey

RUOFYGLAOTYOFP-UHFFFAOYSA-N

Smiles

c1(c(c(ccc1C(C)C)C)C(OC(C)C)=O)OC[C@@H](CNC(C)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 38mg/kg (38mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 156, 1974.