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Substance Name: 1-Indanol, 3-(1-methyl-4-piperidyl)-, fumarate (2:1) (salt)
RN: 20902-73-2
InChIKey: OVOHEHWHEGELKR-WXXKFALUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H42-N2-O2.C4-H4-O4

Molecular Weight

  • 578.745
 
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Names and Synonyms

Synonym

  • 3-(1-Methyl-4-piperidyl)-1-indanol fumarate (2:1)

Systematic Name

  • 1-Indanol, 3-(1-methyl-4-piperidyl)-, fumarate (2:1) (salt)

Registry Numbers

CAS Registry Number

  • 20902-73-2

System Generated Number

  • 0020902732

Molecular Formulas

Molecular Formula

  • C30-H42-N2-O2.C4-H4-O4

Molecular Formula Fragments

  • C30-H42-N2-O2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/2C15H21NO.C4H4O4/c2*1-16-8-6-11(7-9-16)14-10-15(17)13-5-3-2-4-12(13)14;5-3(6)1-2-4(7)8/h2*2-5,11,14-15,17H,6-10H2,1H3;1-2H,(H,5,6)(H,7,8)/b;;2-1+

InChIKey

OVOHEHWHEGELKR-WXXKFALUSA-N

Smiles

C1[C@@H](c2ccccc2[C@@H]1C1CCN(CC1)C)O.C(\C=C\C(=O)O)(=O)O.C1[C@@H](c2ccccc2[C@@H]1C1CCN(CC1)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 150mg/kg (150mg/kg)   Journal of Medicinal Chemistry. Vol. 11, Pg. 1064, 1968.