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Substance Name: Mandelic acid, alpha-acetyl-, 2-(dimethylamino)-1-phenylethyl ester
RN: 73118-22-6
InChIKey: NUSNCQAWMMRWPC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H23-N-O4

Molecular Weight

  • 341.405
 
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Names and Synonyms

Synonyms

  • Acetylmandelic acid (2-(dimethylamino)-1-phenyl)ethyl ester
  • beta-Acetylmandeloyloxy-beta-phenylethyl dimethylamine

Systematic Name

  • Mandelic acid, alpha-acetyl-, 2-(dimethylamino)-1-phenylethyl ester

Registry Numbers

CAS Registry Number

  • 73118-22-6

System Generated Number

  • 0073118226

Structure Descriptors

InChI

1S/C20H23NO4/c1-15(22)20(24,17-12-8-5-9-13-17)19(23)25-18(14-21(2)3)16-10-6-4-7-11-16/h4-13,18,24H,14H2,1-3H3

InChIKey

NUSNCQAWMMRWPC-UHFFFAOYSA-N

Smiles

c1([C@@](C(O[C@@H](c2ccccc2)CN(C)C)=O)(C(C)=O)O)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo subcutaneous 683mg/kg (683mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 47, Pg. 96, 1934.
rabbit LDLo intravenous 34mg/kg (34mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 47, Pg. 96, 1934.