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Substance Name: Benzoic acid, 3,4,5-trimethoxy-, 3-quinuclidinyl ester, (+-)-
RN: 87395-62-8
InChIKey: QTZICPYJFRDZEN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H23-N-O5

Molecular Weight

  • 321.371
 
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Names and Synonyms

Synonyms

  • (+-)-3,4,5-Trimethoxybenzoic acid 3-quinuclidinyl ester
  • BRN 1400199

Systematic Name

  • Benzoic acid, 3,4,5-trimethoxy-, 3-quinuclidinyl ester, (+-)-

Registry Numbers

CAS Registry Number

  • 87395-62-8

System Generated Number

  • 0087395628

Structure Descriptors

InChI

1S/C17H23NO5/c1-20-13-8-12(9-14(21-2)16(13)22-3)17(19)23-15-10-18-6-4-11(15)5-7-18/h8-9,11,15H,4-7,10H2,1-3H3

InChIKey

QTZICPYJFRDZEN-UHFFFAOYSA-N

Smiles

C12[C@@H](OC(c3cc(c(OC)c(c3)OC)OC)=O)CN(CC1)CC2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 18mg/kg (18mg/kg)   Journal of Medicinal Chemistry. Vol. 26, Pg. 1772, 1983.