Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ethanone, 2-(dipropylamino)-1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-, (Z)-2-butenedioate, hydrate (2:2:1)
RN: 67367-67-3
InChIKey: XKXXFPSYPSGPGU-BTJKTKAUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H29-N-O.C4-H4-O4.1/2H2-O

Molecular Weight

  • 415.527
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 2-(Dipropylamino)-1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)ethanone maleate hemihydrate
  • VUFB-10595

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 67367-67-3

System Generated Number

  • 0067367673

Molecular Formulas

Molecular Formula

  • C20-H29-N-O.C4-H4-O4.1/2H2-O

Molecular Formula Fragments

  • C20-H29-N-O
  • C4-H4-O4
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C20H29NO.C4H4O4/c1-3-11-21(12-4-2)14-19(22)20-17-9-5-7-15(17)13-16-8-6-10-18(16)20;5-3(6)1-2-4(7)8/h13H,3-12,14H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

XKXXFPSYPSGPGU-BTJKTKAUSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1500mg/kg (1500mg/kg) KIDNEY, URETER, AND BLADDER: URINE VOLUME INCREASED

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Collection of Czechoslovak Chemical Communications. Vol. 43, Pg. 970, 1978.