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Substance Name: Benzoic acid, 4-butoxy-3-methyl-, 3-(dimethylamino)propyl ester
RN: 78329-86-9
InChIKey: QPAHKFXMGSVTNA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H27-N-O3

Molecular Weight

  • 293.404
 
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Names and Synonyms

Synonyms

  • 3-(Dimethylamino)propyl 4-butoxy-3-methylbenzoate
  • 4-Butoxy-3-methylbenzoic acid 3-(dimethylamino)propyl ester
  • gamma-(Dimethylamino)propyl 3-methyl-4-butoxybenzoate

Systematic Name

  • Benzoic acid, 4-butoxy-3-methyl-, 3-(dimethylamino)propyl ester

Registry Numbers

CAS Registry Number

  • 78329-86-9

System Generated Number

  • 0078329869

Structure Descriptors

InChI

1S/C17H27NO3/c1-5-6-11-20-16-9-8-15(13-14(16)2)17(19)21-12-7-10-18(3)4/h8-9,13H,5-7,10-12H2,1-4H3

InChIKey

QPAHKFXMGSVTNA-UHFFFAOYSA-N

Smiles

c1(cc(c(OCCCC)cc1)C)C(OCCCN(C)C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intravenous 47mg/kg (47mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES Journal of Pharmacology and Experimental Therapeutics. Vol. 63, Pg. 369, 1938.