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Substance Name: Benzoic acid, 4-(2-(2-(4-hydroxy-3-methoxyphenyl)ethenyl)-7-nitro-4-oxo-3(4H)-quinazolinyl)-,methyl ester
RN: 78356-76-0
InChIKey: WPGXMSWHZVCVLQ-UUILKARUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H19-N3-O7

Molecular Weight

  • 473.4391
 
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Names and Synonyms

  • Benzoic acid, 4-(2-(2-(4-hydroxy-3-methoxyphenyl)ethenyl)-7-nitro-4-oxo-3(4H)-quinazolinyl)-,methyl ester

Registry Numbers

CAS Registry Number

  • 78356-76-0

System Generated Number

  • 0078356760

Structure Descriptors

InChI

1S/C25H19N3O7/c1-34-22-13-15(3-11-21(22)29)4-12-23-26-20-14-18(28(32)33)9-10-19(20)24(30)27(23)17-7-5-16(6-8-17)25(31)35-2/h3-14,29H,1-2H3/b12-4+

InChIKey

WPGXMSWHZVCVLQ-UUILKARUSA-N

Smiles

COc1cc(ccc1O)/C=C/c2nc3cc(ccc3c(=O)n2c4ccc(cc4)C(=O)OC)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 32, Pg. 801, 1980.