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Substance Name: 3-Cinnolinecarboxylic acid, 7-chloro-6-fluoro-4-(((4-hydroxyphenyl)methylene)amino)-
RN: 159831-79-5
InChIKey: RLVLMBJONBLFCR-FBCYGCLPSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H9-Cl-F-N3-O3

Molecular Weight

  • 345.7161
 
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Names and Synonyms

Synonym

  • 7-Chloro-6-fluoro-4-(((4-hydroxyphenyl)methylene)amino)-3-cinnolinecarboxylic acid

Systematic Name

  • 3-Cinnolinecarboxylic acid, 7-chloro-6-fluoro-4-(((4-hydroxyphenyl)methylene)amino)-

Registry Numbers

CAS Registry Number

  • 159831-79-5

System Generated Number

  • 0159831795

Structure Descriptors

InChI

1S/C16H9ClFN3O3/c17-11-6-13-10(5-12(11)18)14(15(16(23)24)21-20-13)19-7-8-1-3-9(22)4-2-8/h1-7,22H,(H,23,24)/b19-7+

InChIKey

RLVLMBJONBLFCR-FBCYGCLPSA-N

Smiles

c1cc(ccc1/C=N/c2c3cc(c(cc3nnc2C(=O)O)Cl)F)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported > 2gm/kg (2000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 33, Pg. 1001, 1994.