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Concept information

organooxygen compound > oxacycle > benzopyran > 2-benzopyran > 3-(4-chlorophenyl)-3-[2-(dimethylamino)ethyl]-3,4-dihydro-1h-2-benzopyran-1-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzopyran > 2-benzopyran > 3-(4-chlorophenyl)-3-[2-(dimethylamino)ethyl]-3,4-dihydro-1h-2-benzopyran-1-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzopyran > 2-benzopyran > 3-(4-chlorophenyl)-3-[2-(dimethylamino)ethyl]-3,4-dihydro-1h-2-benzopyran-1-one

Preferred term

3-(4-chlorophenyl)-3-[2-(dimethylamino)ethyl]-3,4-dihydro-1h-2-benzopyran-1-one  

Type

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

Broader concept

charge

  • 0

formula

  • C19H20ClNO2

inchi

  • InChI=1S/C19H20ClNO2/c1-21(2)12-11-19(15-7-9-16(20)10-8-15)13-14-5-3-4-6-17(14)18(22)23-19/h3-10H,11-13H2,1-2H3

inchikey

  • HIVBATDUVFEJFZ-UHFFFAOYSA-N

mass

  • 329.821

monoisotopicmass

  • 329.11826

smiles

  • CN(C)CCC1(CC2=CC=CC=C2C(=O)O1)C3=CC=C(C=C3)Cl

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:103978

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