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Substance Name: Pyrano(3,4-b)indole, 1,3,4,9-tetrahydro-1,9-dimethyl-1-(2-(N-methylpiperazino)ethyl)-, dimaleate
RN: 42920-51-4
InChIKey: LLKFRSSYOAHUMB-LVEZLNDCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H29-N3-O.2C4-H4-O4

Molecular Weight

  • 559.612
 
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Names and Synonyms

Synonym

  • 1-(2-(N-Methylpiperazino)ethyl)-1,9-dimethyl-1,3,4,9-tetrahydropyrano(3,4-b)indole dimaleate

Systematic Name

  • Pyrano(3,4-b)indole, 1,3,4,9-tetrahydro-1,9-dimethyl-1-(2-(N-methylpiperazino)ethyl)-, dimaleate

Registry Numbers

CAS Registry Number

  • 42920-51-4

System Generated Number

  • 0042920514

Molecular Formulas

Molecular Formula

  • C20-H29-N3-O.2C4-H4-O4

Molecular Formula Fragments

  • C20-H29-N3-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C20H29N3O.2C4H4O4/c1-20(9-10-23-13-11-21(2)12-14-23)19-17(8-15-24-20)16-6-4-5-7-18(16)22(19)3;2*5-3(6)1-2-4(7)8/h4-7H,8-15H2,1-3H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+

InChIKey

LLKFRSSYOAHUMB-LVEZLNDCSA-N

Smiles

n1(c2ccccc2c2c1[C@@](OCC2)(CCN1CCN(CC1)C)C)C.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 intraperitoneal 325mg/kg (325mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 10, Pg. 215, 1975.