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Substance Name: Coumarin, 4-dipropylamino-3-nitro-
RN: 50527-32-7
InChIKey: YXNQAAAQDAFEDN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H18-N2-O4

Molecular Weight

  • 290.317
 
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Names and Synonyms

Synonyms

  • 4-Dipropylamino-3-nitrocoumarin
  • 5-18-11-00429 (Beilstein Handbook Reference)
  • BRN 4734462

Systematic Name

  • Coumarin, 4-dipropylamino-3-nitro-

Registry Numbers

CAS Registry Number

  • 50527-32-7

System Generated Number

  • 0050527327

Structure Descriptors

InChI

1S/C15H18N2O4/c1-3-9-16(10-4-2)13-11-7-5-6-8-12(11)21-15(18)14(13)17(19)20/h5-8H,3-4,9-10H2,1-2H3

InChIKey

YXNQAAAQDAFEDN-UHFFFAOYSA-N

Smiles

c1(c2c(oc(c1[N+](=O)[O-])=O)cccc2)N(CCC)CCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg)   Pharmaceutical Chemistry Journal Vol. 12, Pg. 1590, 1978.