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Chemistry, part 1

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Concept information

organochlorine compound > 5-amino-4-chloro-2-(2-hydroxymuconoyl)pyridazin-3(2h)-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > diazines > pyridazines > pyridazinone > 5-amino-4-chloro-2-(2-hydroxymuconoyl)pyridazin-3(2h)-one
... > organic heterocyclic compound > organonitrogen heterocyclic compound > diazines > pyridazines > pyridazinone > 5-amino-4-chloro-2-(2-hydroxymuconoyl)pyridazin-3(2h)-one
... > organic heterocyclic compound > organic heteromonocyclic compound > diazines > pyridazines > pyridazinone > 5-amino-4-chloro-2-(2-hydroxymuconoyl)pyridazin-3(2h)-one

Preferred term

5-amino-4-chloro-2-(2-hydroxymuconoyl)pyridazin-3(2h)-one  

Type

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

Broader concept

alt_id

  • CHEBI:12106
  • CHEBI:2028
  • CHEBI:20542

charge

  • 0

formula

  • C10H8ClN3O5

has_functional_parent

inchi

  • InChI=1S/C10H8ClN3O5/c11-8-5(12)4-13-14(10(8)19)9(18)6(15)2-1-3-7(16)17/h1-4,15H,12H2,(H,16,17)/b3-1+,6-2-

inchikey

  • RXGRVLKXOCEHND-HTNNJDHISA-N

is_conjugate_acid_of

mass

  • 285.64044

monoisotopicmass

  • 285.01525

smiles

  • Nc1cnn(C(=O)C(/O)=C/C=C/C(O)=O)c(=O)c1Cl

subset

  • 3_STAR

synonym EXACT

  • 6-(4-amino-5-chloro-6-oxopyridazin-1(6H)-yl)-5-hydroxy-6-oxohexa-2,4-dienoic acid

synonym RELATED

  • 5-Amino-4-chloro-2-(2-hydroxymuconoyl)-3(2H)-pyridazinone
  • 5-amino-4-chloro-2-(2-hydroxymuconoyl)-3(2H)-pyridazinone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:17881

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