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Substance Name: WV 798
RN: 73771-66-1
InChIKey: FGIRPPYYUKPXNB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H26-Cl-N-O2.C10-H8-O6-S2

Molecular Weight

  • 588.139
 
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Names and Synonyms

Results Name

  • WV 798

Synonyms

  • 5-(2-(N-(2-Chloroethyl)-N-ethylamino)ethoxy)carvacrol 1,5-naphthalenedisulfonate
  • WV 798

Systematic Name

  • Carvacrol, 5-(2-(N-(2-chloroethyl)-N-ethylamino)ethoxy)-, 1,5-naphthalenedisulfonate

Registry Numbers

CAS Registry Number

  • 73771-66-1

System Generated Number

  • 0073771661

Molecular Formulas

Molecular Formula

  • C16-H26-Cl-N-O2.C10-H8-O6-S2

Molecular Formula Fragments

  • C10-H8-O6-S2
  • C16-H26-Cl-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C16H26ClNO2.C10H8O6S2/c1-5-18(7-6-17)8-9-20-16-10-13(4)15(19)11-14(16)12(2)3;11-17(12,13)9-5-1-3-7-8(9)4-2-6-10(7)18(14,15)16/h10-12,19H,5-9H2,1-4H3;1-6H,(H,11,12,13)(H,14,15,16)

InChIKey

FGIRPPYYUKPXNB-UHFFFAOYSA-N

Smiles

c12c(c(ccc2)S(=O)(=O)[O-])cccc1S(O)(=O)=O.c1(c(cc(C)c(c1)O)OCC[N@@H+](CCCl)CC)C(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo subcutaneous 50mg/kg (50mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 17, Pg. 305, 1967.