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Concept information

organooxygen compound > oxacycle > benzoxadiazole > 1-(2,1,3-benzoxadiazol-4-yloxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)-2-butanone
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzoxadiazole > 1-(2,1,3-benzoxadiazol-4-yloxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)-2-butanone
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzoxadiazole > 1-(2,1,3-benzoxadiazol-4-yloxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)-2-butanone

Preferred term

1-(2,1,3-benzoxadiazol-4-yloxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)-2-butanone  

Type

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

Broader concept

charge

  • 0

formula

  • C14H15N5O3

inchi

  • InChI=1S/C14H15N5O3/c1-14(2,3)12(20)13(19-8-15-7-16-19)21-10-6-4-5-9-11(10)18-22-17-9/h4-8,13H,1-3H3

inchikey

  • PODIEYIBRDGSNM-UHFFFAOYSA-N

mass

  • 301.301

monoisotopicmass

  • 301.11749

smiles

  • CC(C)(C)C(=O)C(N1C=NC=N1)OC2=CC=CC3=NON=C32

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:116511

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