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Substance Name: Cyclohexanol, 2-(4-(3-methoxyphenyl)-1-piperazinyl)-6-phenoxy-, dihydrochloride, (1-alpha,2-beta,6-beta)-
RN: 108661-81-0
InChIKey: SKUWJYGIHMJSPR-LBMVOTDDSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H30-N2-O3.2Cl-H

Molecular Weight

  • 455.4228
 
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Names and Synonyms

Synonym

  • (1-alpha,2-beta,6-beta)-2-(4-(3-Methoxyphenyl)-1-piperazinyl)-6-phenoxycyclohexanol 2HCl

Systematic Name

  • Cyclohexanol, 2-(4-(3-methoxyphenyl)-1-piperazinyl)-6-phenoxy-, dihydrochloride, (1-alpha,2-beta,6-beta)-

Registry Numbers

CAS Registry Number

  • 108661-81-0

System Generated Number

  • 0108661810

Molecular Formulas

Molecular Formula

  • C23-H30-N2-O3.2Cl-H

Molecular Formula Fragments

  • C23-H30-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H30N2O3.2ClH/c1-27-20-10-5-7-18(17-20)24-13-15-25(16-14-24)21-11-6-12-22(23(21)26)28-19-8-3-2-4-9-19;;/h2-5,7-10,17,21-23,26H,6,11-16H2,1H3;2*1H/t21-,22+,23+;;/m0../s1

InChIKey

SKUWJYGIHMJSPR-LBMVOTDDSA-N

Smiles

COc1cccc(c1)N2CCN(CC2)[C@H]3CCC[C@H]([C@@H]3O)Oc4ccccc4.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg)   Journal of the Indian Chemical Society. Vol. 62, Pg. 909, 1985.