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Substance Name: 1-Pyrrolidinecarboxamide, 3-(diethylamino)-N,N-diphenyl-, oxalate (1:2)
RN: 20984-77-4
InChIKey: IIAUHRSOPVUXJA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H27-N3-O.2C2-H2-O4

Molecular Weight

  • 517.532
 
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Names and Synonyms

Synonym

  • 3-(Diethylamino)-N,N-diphenyl-1-pyrrolidinecarboxamide oxalate (1:2)

Systematic Name

  • 1-Pyrrolidinecarboxamide, 3-(diethylamino)-N,N-diphenyl-, oxalate (1:2)

Registry Numbers

CAS Registry Number

  • 20984-77-4

System Generated Number

  • 0020984774

Molecular Formulas

Molecular Formula

  • C21-H27-N3-O.2C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C21-H27-N3-O
  • COMPONENT

Structure Descriptors

InChI

1S/C21H27N3O.2C2H2O4/c1-3-22(4-2)20-15-16-23(17-20)21(25)24(18-11-7-5-8-12-18)19-13-9-6-10-14-19;2*3-1(4)2(5)6/h5-14,20H,3-4,15-17H2,1-2H3;2*(H,3,4)(H,5,6)

InChIKey

IIAUHRSOPVUXJA-UHFFFAOYSA-N

Smiles

N1(C[C@@H](N(CC)CC)CC1)C(=O)N(c1ccccc1)c1ccccc1.C(C(=O)O)(=O)O.C(C(=O)O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/kg)   Journal of Medicinal Chemistry. Vol. 11, Pg. 1255, 1968.