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Substance Name: L-Iditol, 1,4:3,6-dianhydro-2-deoxy-2-(methyl(phenylmethyl)amino)-, 5-nitrate, monohydrochloride
RN: 81786-37-0
InChIKey: AJLOGBFMAZZDAG-VMMWHKSHSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H18-N2-O5.Cl-H

Molecular Weight

  • 330.7661
 
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Names and Synonyms

Synonyms

  • 5-(N-Benzyl-N-methylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat-hydrochlorid
  • 5-(N-Benzyl-N-methylamino)-5-desoxy-1,4:3,6-dianhydro-L-idit-2-nitrat-hydrochlorid [German]

Systematic Name

  • L-Iditol, 1,4:3,6-dianhydro-2-deoxy-2-(methyl(phenylmethyl)amino)-, 5-nitrate, monohydrochloride

Registry Numbers

CAS Registry Number

  • 81786-37-0

System Generated Number

  • 0081786370

Molecular Formulas

Molecular Formula

  • C14-H18-N2-O5.Cl-H

Molecular Formula Fragments

  • C14-H18-N2-O5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H18N2O5.ClH/c1-15(7-10-5-3-2-4-6-10)11-8-19-14-12(21-16(17)18)9-20-13(11)14;/h2-6,11-14H,7-9H2,1H3;1H/t11-,12-,13+,14+;/m0./s1

InChIKey

AJLOGBFMAZZDAG-VMMWHKSHSA-N

Smiles

CN(Cc1ccccc1)[C@H]2CO[C@H]3[C@@H]2OC[C@@H]3O[N+](=O)[O-].Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 100mg/kg (100mg/kg)   European Patent Application. Vol. #0044940,