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Substance Name: Benzoic acid, 4,4'-trimethylenedi-, bis(2-diethylaminoethyl) ester, hydrochloride
ID: DI08945000
InChIKey: VYYQBYYMDFGFMN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H42-N2-O4.Cl-H

Molecular Weight

  • 519.1217
 
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Names and Synonyms

Synonyms

  • 4,4'-Trimethylenedibenzoic acid bis(2-diethylaminoethyl) ester hydrochloride
  • Bis(diethylaminoethyl) 4,4'-diphenyl-1,3-propanedicarboxylate hydrochloride

Systematic Name

  • Benzoic acid, 4,4'-trimethylenedi-, bis(2-diethylaminoethyl) ester, hydrochloride

Registry Numbers

ID Number

  • NIOSH/DI0894500

System Generated Number

  • DI08945000

Molecular Formulas

Molecular Formula

  • C29-H42-N2-O4.Cl-H

Molecular Formula Fragments

  • C29-H42-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C29H42N2O4.ClH/c1-5-30(6-2)20-22-34-28(32)26-16-12-24(13-17-26)10-9-11-25-14-18-27(19-15-25)29(33)35-23-21-31(7-3)8-4;/h12-19H,5-11,20-23H2,1-4H3;1H

InChIKey

VYYQBYYMDFGFMN-UHFFFAOYSA-N

Smiles

Cl.CCN(CC)CCOC(=O)c1ccc(CCCc2ccc(cc2)C(=O)OCCN(CC)CC)cc1