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Substance Name: 2H-1-Benzopyran-2-one, 8-(2-ethoxyethoxy)-3-(1H-tetrazol-5-yl)-
RN: 80916-81-0
InChIKey: QZNAWTCGWOPFGI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H14-N4-O4

Molecular Weight

  • 302.2886
 
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Names and Synonyms

Synonyms

  • 8-(2-Ethoxyethoxy)-3-(1H-tetrazol-5-yl)-2H-1-benzopyran-2-one
  • 8-(3-Oxapentyloxy)-3-(1H-tetrazol-5-yl)coumarin

Systematic Name

  • 2H-1-Benzopyran-2-one, 8-(2-ethoxyethoxy)-3-(1H-tetrazol-5-yl)-

Registry Numbers

CAS Registry Number

  • 80916-81-0

System Generated Number

  • 0080916810

Structure Descriptors

InChI

1S/C14H14N4O4/c1-2-20-6-7-21-11-5-3-4-9-8-10(13-15-17-18-16-13)14(19)22-12(9)11/h3-5,8H,2,6-7H2,1H3,(H,15,16,17,18)

InChIKey

QZNAWTCGWOPFGI-UHFFFAOYSA-N

Smiles

CCOCCOc1cccc2c1oc(=O)c(c2)c3[nH]nnn3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1500mg/kg (1500mg/kg)   European Patent Application. Vol. #0039913,