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Chemistry, part 2

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Concept information

organooxygen compound > oxacycle > benzodioxine > 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-n-(3-ethylphenyl)-3-hydroxy-5-nitro-4-triazolimine
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzodioxine > 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-n-(3-ethylphenyl)-3-hydroxy-5-nitro-4-triazolimine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzodioxine > 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-n-(3-ethylphenyl)-3-hydroxy-5-nitro-4-triazolimine
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzodioxine > 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-n-(3-ethylphenyl)-3-hydroxy-5-nitro-4-triazolimine
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > benzodioxine > 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-n-(3-ethylphenyl)-3-hydroxy-5-nitro-4-triazolimine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > benzodioxine > 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-n-(3-ethylphenyl)-3-hydroxy-5-nitro-4-triazolimine
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > benzodioxine > 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-n-(3-ethylphenyl)-3-hydroxy-5-nitro-4-triazolimine

Preferred term

2-(2,3-dihydro-1,4-benzodioxin-6-yl)-n-(3-ethylphenyl)-3-hydroxy-5-nitro-4-triazolimine  

Type

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

Broader concept

charge

  • 0

formula

  • C18H17N5O5

inchi

  • InChI=1S/C18H17N5O5/c1-2-12-4-3-5-13(10-12)19-17-18(23(25)26)20-21(22(17)24)14-6-7-15-16(11-14)28-9-8-27-15/h3-7,10-11,24H,2,8-9H2,1H3

inchikey

  • VUBLJBWQYRMQJL-UHFFFAOYSA-N

mass

  • 383.359

monoisotopicmass

  • 383.12297

smiles

  • CCC1=CC(=CC=C1)N=C2C(=NN(N2O)C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:116228

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