Chem
J-GLOBAL ID：200907009733266896   Nikkaji number：J724.470C

3-[4-(Bromomethyl)phenyl]-7-(diethylamino)coumarin

3-[4-(ブロモメチル)フェニル]-7-(ジエチルアミノ)クマリン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C20H20BrNO2
Molecular formula furigana： C20-H20-BR-N-O2
Molecular weight： 386.289
InChI： InChI=1S/C20H20BrNO2/c1-3-22(4-2)17-10-9-16-11-18(20(23)24-19(16)12-17)15-7-5-14(13-21)6-8-15/h5-12H,3-4,13H2,1-2H3
InChI key： WTCCANMBFQWZMY-UHFFFAOYSA-N
SMILES： CCN(CC)c1ccc2cc(c3ccc(CBr)cc3)c(=O)oc2c1
Systematic name  (4)：
  • 3-[4-(ブロモメチル)フェニル]-7-(ジエチルアミノ)クマリン
  • 7-(ジエチルアミノ)-3-[4-(ブロモメチル)フェニル]-2H-1-ベンゾピラン-2-オン
  • 3-[4-(ブロモメチル)フェニル]-7-(ジエチルアミノ)-2H-クロメン-2-オン
  • 3-[4-(bromomethyl)phenyl]-7-(diethylamino)-2H-chromen-2-one
Other name (2)：
  • 3-[4-(Bromomethyl)phenyl]-7-(diethylamino)coumarin
  • 7-(Diethylamino)-3-[4-(bromomethyl)phenyl]-2H-1-benzopyran-2-one
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