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Substance Name: NSC288021
RN: 37046-70-1
InChIKey: KGNPKWNKJBCYRL-LVEZLNDCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H24-N2.2C4-H4-O4

Molecular Weight

  • 524.567
 
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Names and Synonyms

Results Name

  • NSC288021

Synonym

  • NSC 288021

Systematic Name

  • 5,10-(Iminomethano)-5H-dibenzo(a,d)cycloheptene-13-ethanamine, 10,11-dihydro-N,N-dimethyl-, (Z)-2-butenedioate (1:2)

Registry Numbers

CAS Registry Number

  • 37046-70-1

System Generated Number

  • 0037046701

Molecular Formulas

Molecular Formula

  • C20-H24-N2.2C4-H4-O4

Molecular Formula Fragments

  • C20-H24-N2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C20H24N2.2C4H4O4/c1-22(2)12-11-19-18-13-14-7-3-4-8-15(14)20(21-19)17-10-6-5-9-16(17)18;2*5-3(6)1-2-4(7)8/h3-10,18-21H,11-13H2,1-2H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+

InChIKey

KGNPKWNKJBCYRL-LVEZLNDCSA-N

Smiles

c12C[C@@H]3c4c(cccc4)[C@@H](N[C@@H]3CCN(C)C)c2cccc1.C(\C=C\C(=O)O)(=O)O.C(\C=C\C(=O)O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 150mg/kg (150mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 22, Pg. 632, 1972.