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Substance Name: Spiro(5H-dibenzo(a,d)cycloheptene-5,2'-(1',3')dioxolane), 4'-morpholinomethyl-, maleate
RN: 34753-55-4
InChIKey: BIBTUTRXEHVQBZ-BTJKTKAUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H26-N-O3.C4-H4-O4

Molecular Weight

  • 465.499
 
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Names and Synonyms

Synonym

  • 4'-Morpholinomethylspiro(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'-morpholinomethyl-, maleate

Registry Numbers

CAS Registry Number

  • 34753-55-4

System Generated Number

  • 0034753554

Molecular Formulas

Molecular Formula

  • C22-H26-N-O3.C4-H4-O4

Molecular Formula Fragments

  • C22-H26-N-O3
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C22H23NO3.C4H4O4/c1-3-7-20-17(5-1)9-10-18-6-2-4-8-21(18)22(20)25-16-19(26-22)15-23-11-13-24-14-12-23;5-3(6)1-2-4(7)8/h1-10,19H,11-16H2;1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

BIBTUTRXEHVQBZ-BTJKTKAUSA-N

Smiles

C12(OC[C@@H](O1)CN1CCOCC1)c1c(C=Cc3c2cccc3)cccc1.C(=C/C(=O)O)\C(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2400mg/kg (2400mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 286, 1974.