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Substance Name: Carbamic acid, (2-(hexyloxy)phenyl)-, 2-((4-methyl-1-piperazinyl)methyl)cyclohexyl ester, dihydrochloride, monohydrate, trans-
RN: 130533-76-5
InChIKey: VSWKMMQHIVMSKS-WEYMJNKBSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H41-N3-O3.2Cl-H.H2-O

Molecular Weight

  • 504.5387
 
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Names and Synonyms

Synonym

  • trans-2-((4-Methyl-1-piperazinyl)methyl)cyclohexyl (2-(hexyloxy)phenyl)carbamate 2HCl

Systematic Name

  • Carbamic acid, (2-(hexyloxy)phenyl)-, 2-((4-methyl-1-piperazinyl)methyl)cyclohexyl ester, dihydrochloride, monohydrate, trans-

Registry Numbers

CAS Registry Number

  • 130533-76-5

System Generated Number

  • 0130533765

Molecular Formulas

Molecular Formula

  • C25-H41-N3-O3.2Cl-H.H2-O

Molecular Formula Fragments

  • C25-H41-N3-O3
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C25H41N3O3.2ClH/c1-3-4-5-10-19-30-24-14-9-7-12-22(24)26-25(29)31-23-13-8-6-11-21(23)20-28-17-15-27(2)16-18-28;;/h7,9,12,14,21,23H,3-6,8,10-11,13,15-20H2,1-2H3,(H,26,29);2*1H/t21-,23+;;/m0../s1

InChIKey

VSWKMMQHIVMSKS-WEYMJNKBSA-N

Smiles

CCCCCCOc1ccccc1NC(=O)O[C@@H]2CCCC[C@H]2CN3CCN(CC3)C.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported 200mg/kg (200mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 55, Pg. 1854, 1990.