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Substance Name: 4H-1-Benzopyran-4-one, 3-chloro-2-(1H-tetrazol-5-yl)-
RN: 33550-10-6
InChIKey: LPKGQHBYVFYNTI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H15-Cl-N4-O2

Molecular Weight

  • 248.6285
 
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Names and Synonyms

Synonym

  • 3-Chloro-2-(1H-tetrazol-5-yl)-4H-1-benzopyran-4-one

Systematic Name

  • 4H-1-Benzopyran-4-one, 3-chloro-2-(1H-tetrazol-5-yl)-

Registry Numbers

CAS Registry Number

  • 33550-10-6

System Generated Number

  • 0033550106

Structure Descriptors

InChI

1S/C10H5ClN4O2/c11-7-8(16)5-3-1-2-4-6(5)17-9(7)10-12-14-15-13-10/h1-4H,(H,12,13,14,15)

InChIKey

LPKGQHBYVFYNTI-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)c(=O)c(c(o2)c3[nH]nnn3)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 100mg/kg (100mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 865, 1922.