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Substance Name: Benzoic acid, 2-chloro-5-nitro-, 2-(diethylamino)ethyl ester, monohydrochloride
ID: DG54255000
InChIKey: STCKZSVUEQTFKO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H17-Cl-N2-O4.Cl-H

Molecular Weight

  • 337.2012
 
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Names and Synonyms

Synonym

  • 2-(Diethylamino)ethyl 2-chloro-5-nitrobenzoate monohydrochloride

Systematic Name

  • Benzoic acid, 2-chloro-5-nitro-, 2-(diethylamino)ethyl ester, monohydrochloride

Registry Numbers

ID Number

  • NIOSH/DG5425500

System Generated Number

  • DG54255000

Molecular Formulas

Molecular Formula

  • C13-H17-Cl-N2-O4.Cl-H

Molecular Formula Fragments

  • C13-H17-Cl-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H17ClN2O4.ClH/c1-3-15(4-2)7-8-20-13(17)11-9-10(16(18)19)5-6-12(11)14;/h5-6,9H,3-4,7-8H2,1-2H3;1H

InChIKey

STCKZSVUEQTFKO-UHFFFAOYSA-N

Smiles

C(c1c(ccc(c1)[N+](=O)[O-])Cl)(=O)OCCN(CC)CC.Cl