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Substance Name: Coumarin, 8-((dimethylamino)methyl)-7-hydroxy-4-methyl-, nicotinate (salt)
RN: 10550-21-7
InChIKey: OZUZNIVYDZHRSF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H15-N-O2.C6-H5-N-O2

Molecular Weight

  • 356.376
 
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Names and Synonyms

Synonym

  • 8-((Dimethylamino)methyl)-7-hydroxy-4-methylcoumarin nicotinate (salt)

Systematic Name

  • Coumarin, 8-((dimethylamino)methyl)-7-hydroxy-4-methyl-, nicotinate (salt)

Registry Numbers

CAS Registry Number

  • 10550-21-7

System Generated Number

  • 0010550217

Molecular Formulas

Molecular Formula

  • C13-H15-N-O2.C6-H5-N-O2

Molecular Formula Fragments

  • C13-H15-N-O2
  • C6-H5-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C13H15NO3.C6H5NO2/c1-8-6-12(16)17-13-9(8)4-5-11(15)10(13)7-14(2)3;8-6(9)5-2-1-3-7-4-5/h4-6,15H,7H2,1-3H3;1-4H,(H,8,9)

InChIKey

OZUZNIVYDZHRSF-UHFFFAOYSA-N

Smiles

c12c(c(cc(o2)=O)C)ccc(c1C[NH+](C)C)O.c1(cccnc1)C(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 150mg/kg (150mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

BEHAVIORAL: EXCITEMENT

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD		 Chimica Therapeutica. Vol. 1, Pg. 403, 1966.