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Substance Name: 2H-1-Benzopyran-6-carboxylic acid, 3-(1H-imidazol-1-ylmethyl)-
RN: 129498-34-6
InChIKey: GGCTZXGFWKXKFC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H12-N2-O3

Molecular Weight

  • 256.2598
 
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Names and Synonyms

Synonyms

  • 3-(1H-Imidazol-1-ylmethyl)-2H-1-benzopyran-6-carboxylic acid
  • BRN 4754924

Systematic Name

  • 2H-1-Benzopyran-6-carboxylic acid, 3-(1H-imidazol-1-ylmethyl)-

Registry Numbers

CAS Registry Number

  • 129498-34-6

System Generated Number

  • 0129498346

Structure Descriptors

InChI

1S/C14H12N2O3/c17-14(18)11-1-2-13-12(6-11)5-10(8-19-13)7-16-4-3-15-9-16/h1-6,9H,7-8H2,(H,17,18)

InChIKey

GGCTZXGFWKXKFC-UHFFFAOYSA-N

Smiles

c1cc2c(cc1C(=O)O)C=C(CO2)Cn3ccnc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 200mg/kg (200mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 26, Pg. 423, 1991.