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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenylpropanoid > coumarins > 3-[(7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methoxy]-n,n-dimethyl-5-benzotriazolesulfonamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > coumarins > 3-[(7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methoxy]-n,n-dimethyl-5-benzotriazolesulfonamide
... > organooxygen compound > oxacycle > benzopyran > 1-benzopyran > chromenes > chromenone > coumarins > 3-[(7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methoxy]-n,n-dimethyl-5-benzotriazolesulfonamide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzopyran > 1-benzopyran > chromenes > chromenone > coumarins > 3-[(7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methoxy]-n,n-dimethyl-5-benzotriazolesulfonamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzopyran > 1-benzopyran > chromenes > chromenone > coumarins > 3-[(7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methoxy]-n,n-dimethyl-5-benzotriazolesulfonamide

Preferred term

3-[(7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methoxy]-n,n-dimethyl-5-benzotriazolesulfonamide  

Type

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

Broader concept

charge

  • 0

formula

  • C20H20N4O5S

inchi

  • InChI=1S/C20H20N4O5S/c1-12-5-7-16-14(9-19(25)29-20(16)13(12)2)11-28-24-18-10-15(30(26,27)23(3)4)6-8-17(18)21-22-24/h5-10H,11H2,1-4H3

inchikey

  • PPXUJBXRJOJKDM-UHFFFAOYSA-N

mass

  • 428.463

monoisotopicmass

  • 428.11544

smiles

  • CC1=C(C2=C(C=C1)C(=CC(=O)O2)CON3C4=C(C=CC(=C4)S(=O)(=O)N(C)C)N=N3)C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:121629

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