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Substance Name: Benzoic acid, 1,2-dimethyl-3-(4'-methylpiperidino)propyl ester
RN: 63916-76-7
InChIKey: QJUNWBNYYHDGAM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H27-N-O2

Molecular Weight

  • 289.416
 
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Names and Synonyms

Synonym

  • 1,2-Dimethyl-3-(4'-methylpiperidino)propyl benzoate

Systematic Name

  • Benzoic acid, 1,2-dimethyl-3-(4'-methylpiperidino)propyl ester

Registry Numbers

CAS Registry Number

  • 63916-76-7

System Generated Number

  • 0063916767

Structure Descriptors

InChI

1S/C18H27NO2/c1-14-9-11-19(12-10-14)13-15(2)16(3)21-18(20)17-7-5-4-6-8-17/h4-8,14-16H,9-13H2,1-3H3

InChIKey

QJUNWBNYYHDGAM-UHFFFAOYSA-N

Smiles

c1(C(O[C@@H]([C@@H](CN2CCC(C)CC2)C)C)=O)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 34mg/kg (34mg/kg)   Record of Chemical Progress. Vol. 15, Pg. 143, 1954.