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Substance Name: 2H-1-Benzopyran-2-carboylic acid, 3,4-dihydro-4-(1,4-dihydro-4-oxo-5-pyrimidinyl)-, ethyl ester
RN: 153004-49-0
InChIKey: YMOKXGJQHJZOIH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H16-N2-O4

Molecular Weight

  • 300.3124
 
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Names and Synonyms

Synonym

  • Ethyl 4-(1,4-Dihydro-4-oxo-5-pyrimidinyl)-3,4-dihydro-2H-1-benzopyran-2-carboxylate

Systematic Name

  • 2H-1-Benzopyran-2-carboylic acid, 3,4-dihydro-4-(1,4-dihydro-4-oxo-5-pyrimidinyl)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 153004-49-0

System Generated Number

  • 0153004490

Structure Descriptors

InChI

1S/C16H16N2O4/c1-2-21-16(20)14-7-11(12-8-17-9-18-15(12)19)10-5-3-4-6-13(10)22-14/h3-6,8-9,11,14H,2,7H2,1H3,(H,17,18,19)

InChIKey

YMOKXGJQHJZOIH-UHFFFAOYSA-N

Smiles

CCOC(=O)C1CC(c2ccccc2O1)c3c[nH]cnc3=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 800mg/kg (800mg/kg)   Currents in Toxicology and Therapy. Vol. 1, Pg. 49, 1993.