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Substance Name: Clemizole undecylate
RN: 61853-30-3
UNII: 6K5XAP3A37
InChIKey: WVZNTANSGMGXOL-UHFFFAOYSA-N

Molecular Formula

  • C19-H20-Cl-N3.C11-H22-O2

Molecular Weight

  • 512.1338
 
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Names and Synonyms

Name of Substance

  • Clemizole undecylate

Synonyms

  • EINECS 263-276-3
  • UNII-6K5XAP3A37

Systematic Name

  • Undecanoic acid, compound with 1-((4-chlorophenyl)methyl)-2-(pyrrolidin-1-ylmethyl)-1H-benzimidazole (1:1)

Registry Numbers

CAS Registry Number

  • 61853-30-3

FDA UNII

  • 6K5XAP3A37

System Generated Number

  • 0061853303

Molecular Formulas

Molecular Formula

  • C19-H20-Cl-N3.C11-H22-O2

Molecular Formula Fragments

  • C11-H22-O2
  • C19-H20-Cl-N3
  • COMPONENT

Structure Descriptors

InChI

1S/C19H20ClN3.C11H22O2/c20-16-9-7-15(8-10-16)13-23-18-6-2-1-5-17(18)21-19(23)14-22-11-3-4-12-22;1-2-3-4-5-6-7-8-9-10-11(12)13/h1-2,5-10H,3-4,11-14H2;2-10H2,1H3,(H,12,13)

InChIKey

WVZNTANSGMGXOL-UHFFFAOYSA-N

Smiles

CCCCCCCCCCC(=O)O.c1ccc2c(c1)nc(n2Cc3ccc(cc3)Cl)CN4CCCC4