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Substance Name: Ethanone, 2-(diethylamino)-1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-, (Z)-2-butenedioate (1:1)
RN: 67367-65-1
InChIKey: QVNGYGFNDMINFJ-BTJKTKAUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H25-N-O.C4-H4-O4

Molecular Weight

  • 387.473
 
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Names and Synonyms

Synonyms

  • 2-(Diethylamino)-1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)ethanone maleate
  • 4-(Diethylaminoacetyl)-s-hydrindacene hydrogen maleate
  • VUFB-10601

Systematic Name

  • Ethanone, 2-(diethylamino)-1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 67367-65-1

System Generated Number

  • 0067367651

Molecular Formulas

Molecular Formula

  • C18-H25-N-O.C4-H4-O4

Molecular Formula Fragments

  • C18-H25-N-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C18H25NO.C4H4O4/c1-3-19(4-2)12-17(20)18-15-9-5-7-13(15)11-14-8-6-10-16(14)18;5-3(6)1-2-4(7)8/h11H,3-10,12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

QVNGYGFNDMINFJ-BTJKTKAUSA-N

Smiles

c1(c2c(cc3CCCc13)CCC2)C(C[NH+](CC)CC)=O.C(=C/C(=O)[O-])\C(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 455mg/kg (455mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 43, Pg. 970, 1978.
rat LD50 oral 2220mg/kg (2220mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 43, Pg. 970, 1978.