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Substance Name: 1H-Imidazole-1-acetic acid, 5-ethyl-2-nitro-, ethyl ester
RN: 23571-54-2
InChIKey: OVKDZRWGBXJOPR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H13-N3-O4

Molecular Weight

  • 227.2187
 
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Names and Synonyms

Synonyms

  • 5-23-05-00171 (Beilstein Handbook Reference)
  • BRN 0663193
  • Imidazole-1-acetic acid, 5-ethyl-2-nitro-, ethyl ester
  • L 7138

Systematic Name

  • 1H-Imidazole-1-acetic acid, 5-ethyl-2-nitro-, ethyl ester

Registry Numbers

CAS Registry Number

  • 23571-54-2

System Generated Number

  • 0023571542

Structure Descriptors

InChI

1S/C9H13N3O4/c1-3-7-5-10-9(12(14)15)11(7)6-8(13)16-4-2/h5H,3-4,6H2,1-2H3

InChIKey

OVKDZRWGBXJOPR-UHFFFAOYSA-N

Smiles

CCOC(=O)Cn1c(CC)cnc1[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 2gm/kg (2000mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 775, 1969.