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Substance Name: Spiro(dibenz(b,e)oxepin-11,2'-(1',3')dioxolane), 6,11-dihydro-4'-(1-pyrrolidinyl)methyl-, maleate
RN: 39890-17-0
InChIKey: SLLVSPMAIZWWJN-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H23-N-O3.C4-H4-O4

Molecular Weight

  • 453.4883
 
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Names and Synonyms

  • Spiro(dibenz(b,e)oxepin-11,2'-(1',3')dioxolane), 6,11-dihydro-4'-(1-pyrrolidinyl)methyl-, maleate

Registry Numbers

CAS Registry Number

  • 39890-17-0

System Generated Number

  • 0039890170

Molecular Formulas

Molecular Formula

  • C21-H23-N-O3.C4-H4-O4

Molecular Formula Fragments

  • C21-H23-N-O3
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C21H23NO3.C4H4O4/c1-2-8-18-16(7-1)14-23-20-10-4-3-9-19(20)21(18)24-15-17(25-21)13-22-11-5-6-12-22;5-3(6)1-2-4(7)8/h1-4,7-10,17H,5-6,11-15H2;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

SLLVSPMAIZWWJN-WLHGVMLRSA-N

Smiles

c1ccc2c(c1)COc3ccccc3C24OCC(O4)CN5CCCC5.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 700mg/kg (700mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 286, 1974.