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Substance Name: Benzoic acid, 3,4-dimethoxy-, 4-(ethyl(1,2,3,4-tetrahydro-6-methoxy-2-naphthalenyl)amino)butyl ester, hydrochloride
RN: 69788-31-4
InChIKey: UPMYHICLIINOMI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H35-N-O5.Cl-H

Molecular Weight

  • 478.0254
 
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Names and Synonyms

Synonym

  • 4-(Ethyl(1,2,3,4-tetrahydro-6-methoxy-2-naphthalenyl)amino)butyl 3,4-dimethoxybenzoate HCl

Systematic Name

  • Benzoic acid, 3,4-dimethoxy-, 4-(ethyl(1,2,3,4-tetrahydro-6-methoxy-2-naphthalenyl)amino)butyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 69788-31-4

System Generated Number

  • 0069788314

Molecular Formulas

Molecular Formula

  • C26-H35-N-O5.Cl-H

Molecular Formula Fragments

  • C26-H35-N-O5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C26H35NO5.ClH/c1-5-27(22-11-8-20-17-23(29-2)12-9-19(20)16-22)14-6-7-15-32-26(28)21-10-13-24(30-3)25(18-21)31-4;/h9-10,12-13,17-18,22H,5-8,11,14-16H2,1-4H3;1H

InChIKey

UPMYHICLIINOMI-UHFFFAOYSA-N

Smiles

CCN(CCCCOC(=O)c1ccc(c(c1)OC)OC)C2CCc3cc(ccc3C2)OC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 19300ug/kg (19.3mg/kg)   German Offenlegungsschrift Patent Document. Vol. #2821584,
rat LD50 oral > 2gm/kg (2000mg/kg)   German Offenlegungsschrift Patent Document. Vol. #2821584,