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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > c-nitro compound > nitrohydrocarbon > nitroarene > nitronaphthalene > 3-(5,8-dinitro-1,3-dioxo-2-benzo[de]isoquinolinyl)benzoic acid

Preferred term

3-(5,8-dinitro-1,3-dioxo-2-benzo[de]isoquinolinyl)benzoic acid  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C19H9N3O8

inchi

  • InChI=1S/C19H9N3O8/c23-17-14-7-12(21(27)28)5-10-6-13(22(29)30)8-15(16(10)14)18(24)20(17)11-3-1-2-9(4-11)19(25)26/h1-8H,(H,25,26)

inchikey

  • NIPZTHWSGKAQER-UHFFFAOYSA-N

mass

  • 407.291

monoisotopicmass

  • 407.03896

smiles

  • C1=CC(=CC(=C1)N2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-])[N+](=O)[O-])C(=O)O

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:116871

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