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Substance Name: Benzyl L-ornithine di(4-toluenesulphonate)
RN: 33303-49-0
InChIKey: IUNSCWXAJURFKJ-IDMXKUIJSA-N

Molecular Formula

  • C12-H18-N2-O2.2C7-H8-O3-S

Molecular Weight

  • 566.6926
 
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Names and Synonyms

Synonym

  • EINECS 251-447-5

Systematic Name

  • Benzyl L-ornithine di(4-toluenesulphonate)

Registry Numbers

CAS Registry Number

  • 33303-49-0

System Generated Number

  • 0033303490

Molecular Formulas

Molecular Formula

  • C12-H18-N2-O2.2C7-H8-O3-S

Molecular Formula Fragments

  • C12-H18-N2-O2
  • C7-H8-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C12H18N2O2.2C7H8O3S/c13-8-4-7-11(14)12(15)16-9-10-5-2-1-3-6-10;2*1-6-2-4-7(5-3-6)11(8,9)10/h1-3,5-6,11H,4,7-9,13-14H2;2*2-5H,1H3,(H,8,9,10)/t11-;;/m0../s1

InChIKey

IUNSCWXAJURFKJ-IDMXKUIJSA-N

Smiles

S(=O)(=O)(c1ccc(cc1)C)O.C(=O)(OCc1ccccc1)[C@@H](N)CCCN.S(=O)(=O)(c1ccc(cc1)C)O