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Substance Name: Benzoic acid, 4-amino-2-(benzyloxy)-, 3-piperidinopropyl ester, hydrogen phosphate
RN: 100347-84-0
InChIKey: ZEFJKTDVBATXPM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H28-N2-O3.H3-O4-P

Molecular Weight

  • 466.468
 
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Names and Synonyms

Synonyms

  • 4-Amino-2-(benzyloxy)benzoic acid 3-piperidinopropyl ester hydrogen phosphate
  • WIN 3503

Systematic Name

  • Benzoic acid, 4-amino-2-(benzyloxy)-, 3-piperidinopropyl ester, hydrogen phosphate

Registry Numbers

CAS Registry Number

  • 100347-84-0

System Generated Number

  • 0100347840

Molecular Formulas

Molecular Formula

  • C22-H28-N2-O3.H3-O4-P

Molecular Formula Fragments

  • C22-H28-N2-O3
  • COMPONENT
  • H3-O4-P

Structure Descriptors

InChI

1S/C22H28N2O3.H3O4P/c23-19-10-11-20(21(16-19)27-17-18-8-3-1-4-9-18)22(25)26-15-7-14-24-12-5-2-6-13-24;1-5(2,3)4/h1,3-4,8-11,16H,2,5-7,12-15,17,23H2;(H3,1,2,3,4)

InChIKey

ZEFJKTDVBATXPM-UHFFFAOYSA-N

Smiles

c1(c(ccc(c1)N)C(OCCC[NH+]1CCCCC1)=O)OCc1ccccc1.P(O)(O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 14mg/kg (14mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Pharmacology and Experimental Therapeutics. Vol. 104, Pg. 40, 1952.