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Substance Name: 1-Adamantanecarboxylic acid, (2-bromo-3-(5-nitro-2-furyl)allylidene)hydrazide
RN: 26474-93-1
InChIKey: OCGMUUXPFAVYNG-BKQRPXPXSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H20-Br-N3-O4

Molecular Weight

  • 422.277
 
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Names and Synonyms

Synonyms

  • 3-(5'-Nitro-2'-furyl)-2-bromo-prop-2-en-1-al (3-adamantoyl)hydrazone
  • BRN 1606766

Systematic Name

  • 1-Adamantanecarboxylic acid, (2-bromo-3-(5-nitro-2-furyl)allylidene)hydrazide

Registry Numbers

CAS Registry Number

  • 26474-93-1

System Generated Number

  • 0026474931

Structure Descriptors

InChI

1S/C18H20BrN3O4/c19-14(6-15-1-2-16(26-15)22(24)25)10-20-21-17(23)18-7-11-3-12(8-18)5-13(4-11)9-18/h1-2,6,10-13H,3-5,7-9H2,(H,21,23)/b14-6-,20-10+

InChIKey

OCGMUUXPFAVYNG-BKQRPXPXSA-N

Smiles

C1C2CC3CC1(CC(C2)C3)C(=O)N\N=C\C(=C\c1oc(cc1)[N+]([O-])=O)Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 3gm/kg (3000mg/kg)   British Patent Document. Vol. #1241137,