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Substance Name: Morpholinium, 4-(2-(N-benzyl-p-nitrobenzamido)ethyl)-4-methyl-, bromide
RN: 1638-53-5
InChIKey: FNFJGUCQNMYSHQ-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H26-N3-O4.Br

Molecular Weight

  • 464.357
 
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Names and Synonyms

Synonyms

  • 4-(2-(N-Benzyl-p-nitrobenzamido)ethyl)-4-methylmorpholinium bromide
  • Morpholinium, 4-methyl-4-(2-((4-nitrobenzoyl)(phenylmethyl)amino)ethyl)-, bromide

Systematic Name

  • Morpholinium, 4-(2-(N-benzyl-p-nitrobenzamido)ethyl)-4-methyl-, bromide

Registry Numbers

CAS Registry Number

  • 1638-53-5

System Generated Number

  • 0001638535

Molecular Formulas

Molecular Formula

  • C21-H26-N3-O4.Br

Molecular Formula Fragments

  • Br
  • C21-H26-N3-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C21H26N3O4.BrH/c1-24(13-15-28-16-14-24)12-11-22(17-18-5-3-2-4-6-18)21(25)19-7-9-20(10-8-19)23(26)27;/h2-10H,11-17H2,1H3;1H/q+1;/p-1

InChIKey

FNFJGUCQNMYSHQ-UHFFFAOYSA-M

Smiles

c1(ccc(C(=O)N(CC[N+]2(CCOCC2)C)Cc2ccccc2)cc1)[N+]([O-])=O.[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 20mg/kg (20mg/kg)   Therapie. Vol. 20, Pg. 173, 1965.