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Substance Name: Benzamide, 4-((chloroacetyl)amino)-N-(2-(diethylamino)ethyl)-, ethanedioate (1:1)
RN: 104816-29-7
InChIKey: MOUWFHYXDXUHEX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H22-Cl-N3-O6.C2-H2-O4

Molecular Weight

  • 401.845
 
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Names and Synonyms

Synonym

  • 4-((Chloroacetyl)amino)-N-(2-(diethylamino)ethyl)benzamide ethanedioate (1:1)

Systematic Name

  • Benzamide, 4-((chloroacetyl)amino)-N-(2-(diethylamino)ethyl)-, ethanedioate (1:1)

Registry Numbers

CAS Registry Number

  • 104816-29-7

System Generated Number

  • 0104816297

Molecular Formulas

Molecular Formula

  • C15-H22-Cl-N3-O6.C2-H2-O4

Molecular Formula Fragments

  • C15-H22-Cl-N3-O6
  • C2-H2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C15H22ClN3O2.C2H2O4/c1-3-19(4-2)10-9-17-15(21)12-5-7-13(8-6-12)18-14(20)11-16;3-1(4)2(5)6/h5-8H,3-4,9-11H2,1-2H3,(H,17,21)(H,18,20);(H,3,4)(H,5,6)

InChIKey

MOUWFHYXDXUHEX-UHFFFAOYSA-N

Smiles

c1(ccc(NC(CCl)=O)cc1)C(NCC[NH+](CC)CC)=O.C(C(=O)[O-])(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 22983mg/kg (22983mg/kg)   Acta Poloniae Pharmaceutica. For English translation, see APPFAR. Vol. 42, Pg. 367, 1985.