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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > quinazolines > 4-[3-(/{4-[(3-chloro-4-fluorophenyl)amino]-7-methoxyquinazolin-6-yl/}oxy)propyl]-4-hydroxymorpholin-4-ium
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > quinazolines > 4-[3-(/{4-[(3-chloro-4-fluorophenyl)amino]-7-methoxyquinazolin-6-yl/}oxy)propyl]-4-hydroxymorpholin-4-ium
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > quinazolines > 4-[3-(/{4-[(3-chloro-4-fluorophenyl)amino]-7-methoxyquinazolin-6-yl/}oxy)propyl]-4-hydroxymorpholin-4-ium
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > quinazolines > 4-[3-(/{4-[(3-chloro-4-fluorophenyl)amino]-7-methoxyquinazolin-6-yl/}oxy)propyl]-4-hydroxymorpholin-4-ium

Preferred term

4-[3-(/{4-[(3-chloro-4-fluorophenyl)amino]-7-methoxyquinazolin-6-yl/}oxy)propyl]-4-hydroxymorpholin-4-ium  

Type

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

Broader concept

charge

  • +1

formula

  • C22H25ClFN4O4

inchi

  • InChI=1S/C22H25ClFN4O4/c1-30-20-13-19-16(12-21(20)32-8-2-5-28(29)6-9-31-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14,29H,2,5-10H2,1H3,(H,25,26,27)/q+1

inchikey

  • UPRBZWYTFAVTJS-UHFFFAOYSA-N

mass

  • 463.910

monoisotopicmass

  • 463.155

smiles

  • ClC1=C(F)C=CC(=C1)NC2=NC=NC=3C2=CC(OCCC[N+]4(O)CCOCC4)=C(C3)OC

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:143397

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