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Substance Name: Acetic acid, (6-isopropyl-2-methoxycarbonyl-3-methylphenoxy)-, 2-(dimethylamino)ethyl ester
RN: 52073-09-3
InChIKey: IBHICZHJJGSIKX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H27-N-O5

Molecular Weight

  • 337.413
 
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Names and Synonyms

Synonyms

  • BRN 2769657
  • p-Cymene-2-carboxylic acid, 3-(2-dimethylamino)ethoxycarbonylmethoxy-, methyl ester

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 52073-09-3

System Generated Number

  • 0052073093

Structure Descriptors

InChI

1S/C18H27NO5/c1-12(2)14-8-7-13(3)16(18(21)22-6)17(14)24-11-15(20)23-10-9-19(4)5/h7-8,12H,9-11H2,1-6H3

InChIKey

IBHICZHJJGSIKX-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 135mg/kg (135mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 156, 1974.