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Substance Name: Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester
RN: 17822-59-2
InChIKey: NYJXQBWDAHRYQB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H27-N-O3

Molecular Weight

  • 353.459
 
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Names and Synonyms

Synonyms

  • 2-(Cyclopentylmethylamino)ethyl benzilate
  • BRN 2168199

Systematic Name

  • Benzilic acid, 2-(cyclopentylmethylamino)ethyl ester

Registry Numbers

CAS Registry Number

  • 17822-59-2

System Generated Number

  • 0017822592

Structure Descriptors

InChI

1S/C22H27NO3/c1-23(20-14-8-9-15-20)16-17-26-21(24)22(25,18-10-4-2-5-11-18)19-12-6-3-7-13-19/h2-7,10-13,20,25H,8-9,14-17H2,1H3

InChIKey

NYJXQBWDAHRYQB-UHFFFAOYSA-N

Smiles

c1(ccccc1)C(C(=O)OCC[N@@](C)C1CCCC1)(c1ccccc1)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 185mg/kg (185mg/kg)   Pharmaceutical Chemistry Journal Vol. 2, Pg. 201, 1968.