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Substance Name: 4-Piperidinol, 1-(3-(diethylamino)propyl)-2,5-dimethyl-4-phenyl-, propionate (ester), ditartrate, dihydrate
RN: 54521-97-0
InChIKey: ILXNJCIMPUTTOP-ZYYAQZALSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H38-N2-O2.2C4-H6-O6.2H2-O

Molecular Weight

  • 674.736
 
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Names and Synonyms

Synonym

  • Propionic acid, 1-(diethylaminopropyl)-2,5-dimethyl-4-phenyl-4-piperidinyl ester

Systematic Name

  • 4-Piperidinol, 1-(3-(diethylamino)propyl)-2,5-dimethyl-4-phenyl-, propionate (ester), ditartrate, dihydrate

Registry Numbers

CAS Registry Number

  • 54521-97-0

System Generated Number

  • 0054521970

Molecular Formulas

Molecular Formula

  • C23-H38-N2-O2.2C4-H6-O6.2H2-O

Molecular Formula Fragments

  • C23-H38-N2-O2
  • C4-H6-O6
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C23H38N2O2.2C4H6O6/c1-6-22(26)27-23(21-13-10-9-11-14-21)17-20(5)25(18-19(23)4)16-12-15-24(7-2)8-3;2*5-1(3(7)8)2(6)4(9)10/h9-11,13-14,19-20H,6-8,12,15-18H2,1-5H3;2*1-2,5-6H,(H,7,8)(H,9,10)/t;2*1-,2-/m.00/s1

InChIKey

ILXNJCIMPUTTOP-ZYYAQZALSA-N

Smiles

CCC(=O)OC1(CC(N(CC1C)CCCN(CC)CC)C)c2ccccc2.[C@H]([C@@H](C(=O)O)O)(C(=O)O)O.[C@H]([C@@H](C(=O)O)O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg) VASCULAR: BP LOWERING NOT CHARACTERIZED IN AUTONOMIC SECTION

AUTONOMIC NERVOUS SYSTEM: PARASYMPATHOLYTIC
Pharmaceutical Chemistry Journal Vol. 8, Pg. 597, 1974.