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Substance Name: 4H-1-Benzopyran-4-one, 7-(phenylmethoxy)-2-(1H-tetrazol-5-yl)-
RN: 33549-95-0
InChIKey: RTOLKYBAJMRTMR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H12-N4-O3

Molecular Weight

  • 320.307
 
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Names and Synonyms

Synonyms

  • 7-(Phenylmethoxy)-2-(1H-tetrazol-5-yl)-4H-1-benzopyran-4-one
  • BRN 0840049

Systematic Name

  • 4H-1-Benzopyran-4-one, 7-(phenylmethoxy)-2-(1H-tetrazol-5-yl)-

Registry Numbers

CAS Registry Number

  • 33549-95-0

System Generated Number

  • 0033549950

Structure Descriptors

InChI

1S/C17H12N4O3/c22-14-9-16(17-18-20-21-19-17)24-15-8-12(6-7-13(14)15)23-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,18,19,20,21)

InChIKey

RTOLKYBAJMRTMR-UHFFFAOYSA-N

Smiles

c1(cc(c2c(o1)cc(cc2)OCc1ccccc1)=O)c1nnn[nH]1

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, 1972.