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Substance Name: Piperidinium, 1-(2-(N-benzyl-p-anisidino)ethyl)-1-methyl-, iodide, ethanol
RN: 102207-17-0
InChIKey: PBAIXWXLHUEKJM-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H31-N2-O.I.C2-H6-O

Molecular Weight

  • 512.4683
 
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Names and Synonyms

Synonyms

  • 1-(2-(N-Benzyl-p-anisidino)ethyl)-1-methyl-piperidinium iodide ethanol
  • RTECS TP8736000

Systematic Name

  • Piperidinium, 1-(2-(N-benzyl-p-anisidino)ethyl)-1-methyl-, iodide, ethanol

Registry Numbers

CAS Registry Number

  • 102207-17-0

System Generated Number

  • 0102207170

Molecular Formulas

Molecular Formula

  • C22-H31-N2-O.I.C2-H6-O

Molecular Formula Fragments

  • C2-H6-O
  • C22-H31-N2-O
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C22H31N2O.C2H6O.HI/c1-24(16-7-4-8-17-24)18-15-23(19-20-9-5-3-6-10-20)21-11-13-22(25-2)14-12-21;1-2-3;/h3,5-6,9-14H,4,7-8,15-19H2,1-2H3;3H,2H2,1H3;1H/q+1;;/p-1

InChIKey

PBAIXWXLHUEKJM-UHFFFAOYSA-M

Smiles

CCO.C[N+]1(CCCCC1)CCN(Cc2ccccc2)c3ccc(cc3)OC.[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 50mg/kg (50mg/kg)   Farmaco, Edizione Scientifica. Vol. 15, Pg. 821, 1960.