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Substance Name: Propionanilide, N-(3-methyl-1-phenethyl-4-piperidyl)-, compd with propanol (1:1), nitrate, Z-(+)-
RN: 63916-03-0
InChIKey: DIFUVRDFPAVFKW-GOOHIXEASA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H30-N2-O.C3-H8-O.H-N-O3

Molecular Weight

  • 473.6101
 
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Names and Synonyms

Synonym

  • cis-(+)-N-(3-Methyl-1-(2-phenylethyl)-4-piperidyl)-N-phenylpropanamide and propanol nitrate

Systematic Name

  • Propionanilide, N-(3-methyl-1-phenethyl-4-piperidyl)-, compd with propanol (1:1), nitrate, Z-(+)-

Registry Numbers

CAS Registry Number

  • 63916-03-0

System Generated Number

  • 0063916030

Molecular Formulas

Molecular Formula

  • C23-H30-N2-O.C3-H8-O.H-N-O3

Molecular Formula Fragments

  • C23-H30-N2-O
  • C3-H8-O
  • COMPONENT
  • H-N-O3

Structure Descriptors

InChI

1S/C23H30N2O.C3H8O.HNO3/c1-3-23(26)25(21-12-8-5-9-13-21)22-15-17-24(18-19(22)2)16-14-20-10-6-4-7-11-20;1-2-3-4;2-1(3)4/h4-13,19,22H,3,14-18H2,1-2H3;4H,2-3H2,1H3;(H,2,3,4)/t19-,22+;;/m1../s1

InChIKey

DIFUVRDFPAVFKW-GOOHIXEASA-N

Smiles

CCCO.CCC(=O)N([C@H]1CCN(CCc2ccccc2)C[C@H]1C)c3ccccc3.O[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 1080ug/kg (1.08mg/kg)   Journal of Medicinal Chemistry. Vol. 17, Pg. 1047, 1974.