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Substance Name: Acetic acid, (6-isopropyl-2-methoxycarbonyl-3-methylphenoxy)-, 2-(diethylamino)ethyl ester
RN: 52073-15-1
InChIKey: KLSLAJCPPHOEAM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H31-N-O5

Molecular Weight

  • 365.467
 
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Names and Synonyms

Synonyms

  • BRN 2774743
  • p-Cymene-2-carboxylic acid, 3-(2-(diethylamino)ethoxycarbonylmethoxy)-, methyl ester

Systematic Name

  • Acetic acid, (6-isopropyl-2-methoxycarbonyl-3-methylphenoxy)-, 2-(diethylamino)ethyl ester

Registry Numbers

CAS Registry Number

  • 52073-15-1

System Generated Number

  • 0052073151

Structure Descriptors

InChI

1S/C20H31NO5/c1-7-21(8-2)11-12-25-17(22)13-26-19-16(14(3)4)10-9-15(5)18(19)20(23)24-6/h9-10,14H,7-8,11-13H2,1-6H3

InChIKey

KLSLAJCPPHOEAM-UHFFFAOYSA-N

Smiles

c1(c(c(ccc1C(C)C)C)C(OC)=O)OCC(OCCN(CC)CC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 82mg/kg (82mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 156, 1974.