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Substance Name: Spiro(5H-dibenzo(a,d)cycloheptene-5,2'-(1',3')dioxolane), 4'-(ethylamino)methyl-, maleate
RN: 52467-35-3
InChIKey: YLRCAHBRRAUPEB-BTJKTKAUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H24-N-O2.C4-H4-O4

Molecular Weight

  • 423.462
 
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Names and Synonyms

Synonym

  • 4'-(Ethylamino)methylspiro(5H-dibenzo(a,d)cycloheptene-5,2'-(1',3')dioxolane) maleate

Systematic Name

  • Spiro(5H-dibenzo(a,d)cycloheptene-5,2'-(1',3')dioxolane), 4'-(ethylamino)methyl-, maleate

Registry Numbers

CAS Registry Number

  • 52467-35-3

System Generated Number

  • 0052467353

Molecular Formulas

Molecular Formula

  • C20-H24-N-O2.C4-H4-O4

Molecular Formula Fragments

  • C20-H24-N-O2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C20H21NO2.C4H4O4/c1-2-21-13-17-14-22-20(23-17)18-9-5-3-7-15(18)11-12-16-8-4-6-10-19(16)20;5-3(6)1-2-4(7)8/h3-12,17,21H,2,13-14H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

YLRCAHBRRAUPEB-BTJKTKAUSA-N

Smiles

C12(OC[C@@H](O1)CNCC)c1c(C=Cc3c2cccc3)cccc1.C(\C=C/C(=O)O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 375mg/kg (375mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 286, 1974.