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Substance Name: Caldaret [INN]
RN: 133804-44-1
UNII: 9L3Y3IJ2HI
InChIKey: DCDFLGVJWQIRGH-UHFFFAOYSA-N

Note

  • May have cardiotonic activity.

Molecular Formula

  • C11-H16-N2-O3-S

Molecular Weight

  • 256.3244
 
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Names and Synonyms

Name of Substance

  • Caldaret
  • Caldaret [INN]

Synonyms

  • 5-Methyl-2-(piperazin-1-yl)benzenesulfonic acid
  • Caldaret
  • MCC 135
  • UNII-9L3Y3IJ2HI

Systematic Name

  • Benzenesulfonic acid, 5-methyl-2-(1-piperazinyl)-

Registry Numbers

CAS Registry Number

  • 133804-44-1

FDA UNII

  • 9L3Y3IJ2HI

System Generated Number

  • 0133804441

Structure Descriptors

InChI

1S/C11H16N2O3S/c1-9-2-3-10(11(8-9)17(14,15)16)13-6-4-12-5-7-13/h2-3,8,12H,4-7H2,1H3,(H,14,15,16)

InChIKey

DCDFLGVJWQIRGH-UHFFFAOYSA-N

Smiles

Cc1ccc(c(c1)S(=O)(=O)O)N2CCNCC2