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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenylpropanoid > coumarins > hydroxycoumarin > 6-chloro-4-[[(2-fluorophenyl)methyl-methylamino]methyl]-7-hydroxy-1-benzopyran-2-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > coumarins > hydroxycoumarin > 6-chloro-4-[[(2-fluorophenyl)methyl-methylamino]methyl]-7-hydroxy-1-benzopyran-2-one
... > organooxygen compound > oxacycle > benzopyran > 1-benzopyran > chromenes > chromenone > coumarins > hydroxycoumarin > 6-chloro-4-[[(2-fluorophenyl)methyl-methylamino]methyl]-7-hydroxy-1-benzopyran-2-one

Preferred term

6-chloro-4-[[(2-fluorophenyl)methyl-methylamino]methyl]-7-hydroxy-1-benzopyran-2-one  

Type

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

Broader concept

charge

  • 0

formula

  • C18H15ClFNO3

inchi

  • InChI=1S/C18H15ClFNO3/c1-21(9-11-4-2-3-5-15(11)20)10-12-6-18(23)24-17-8-16(22)14(19)7-13(12)17/h2-8,22H,9-10H2,1H3

inchikey

  • APEBDJMZLASLIL-UHFFFAOYSA-N

mass

  • 347.769

monoisotopicmass

  • 347.07245

smiles

  • CN(CC1=CC=CC=C1F)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)O

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:121090

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