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Substance Name: Acetic acid, 2,2-diphenyl-, (2,2-dimethyl-3-morpholinopropyl) ester, hydrogen sulfate (2:1)
RN: 66859-41-4
InChIKey: NBJMTXCDGZJUPX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H29.1/2H2-O4-S

Molecular Weight

  • 465.564
 
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Names and Synonyms

Synonym

  • 2,2-Diphenylacetic acid (2,2-dimethyl-3-morpholinopropyl) ester hydrogen sulfate (2:1)

Systematic Name

  • Acetic acid, 2,2-diphenyl-, (2,2-dimethyl-3-morpholinopropyl) ester, hydrogen sulfate (2:1)

Registry Numbers

CAS Registry Number

  • 66859-41-4

System Generated Number

  • 0066859414

Molecular Formulas

Molecular Formula

  • C23-H29.1/2H2-O4-S

Molecular Formula Fragments

  • C23-H29
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/C23H29NO3.H2O4S/c1-23(2,17-24-13-15-26-16-14-24)18-27-22(25)21(19-9-5-3-6-10-19)20-11-7-4-8-12-20;1-5(2,3)4/h3-12,21H,13-18H2,1-2H3;(H2,1,2,3,4)

InChIKey

NBJMTXCDGZJUPX-UHFFFAOYSA-N

Smiles

C(c1ccccc1)(c1ccccc1)C(OCC(C[NH+]1CCOCC1)(C)C)=O.S(O)(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 1gm/kg (1000mg/kg)   Journal of the American Chemical Society. Vol. 64, Pg. 970, 1942.