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Substance Name: 2H-1-Benzopyran-2-one, 7-chloro-4-(2-(5-nitro-2-furanyl)ethenyl)-, (E)-
RN: 68746-85-0
InChIKey: ZEKINZMYTRTKGR-HNQUOIGGSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H8-Cl-N-O5

Molecular Weight

  • 317.6832
 
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Names and Synonyms

Synonyms

  • (E)-7-Chloro-4-(2-(5-nitro-2-furanyl)ethenyl)-2H-1-benzopyran-2-one
  • 7-Chloro-4-(2-(5-nitro-2-furyl)vinyl)coumarin

Systematic Name

  • 2H-1-Benzopyran-2-one, 7-chloro-4-(2-(5-nitro-2-furanyl)ethenyl)-, (E)-

Registry Numbers

CAS Registry Number

  • 68746-85-0

System Generated Number

  • 0068746850

Structure Descriptors

InChI

1S/C15H8ClNO5/c16-10-2-5-12-9(7-15(18)22-13(12)8-10)1-3-11-4-6-14(21-11)17(19)20/h1-8H/b3-1+

InChIKey

ZEKINZMYTRTKGR-HNQUOIGGSA-N

Smiles

c1cc2c(cc(=O)oc2cc1Cl)/C=C/c3ccc(o3)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 oral > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 16, Pg. 704, 1978.