Chem
J-GLOBAL ID：200907002701986396   Nikkaji number：J1.103.323G

1-(6-Bromo-1,3-benzodioxole-5-ylmethyl)-1,4,5,6-tetrahydro-2H-indole-2-one

1-(6-ブロモ-1,3-ベンゾジオキソール-5-イルメチル)-1,4,5,6-テトラヒドロ-2H-インドール-2-オン
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： C16H14BrNO3
Molecular formula furigana： C16-H14-BR-N-O3
Molecular weight： 348.196
InChI： InChI=1S/C16H14BrNO3/c17-12-7-15-14(20-9-21-15)5-11(12)8-18-13-4-2-1-3-10(13)6-16(18)19/h4-7H,1-3,8-9H2
InChI key： CXFSJJAIPIDFGM-UHFFFAOYSA-N
SMILES： Brc1cc2OCOc2cc1CN1C(=O)C=C2CCCC=C12
Systematic name  (3)：
  • 1-(6-ブロモ-1,3-ベンゾジオキソール-5-イルメチル)-1,4,5,6-テトラヒドロ-2H-インドール-2-オン
  • 1-[(6-ブロモ-2H-1,3-ベンゾジオキソール-5-イル)メチル]-2,4,5,6-テトラヒドロ-1H-インドール-2-オン
  • 1-[(6-bromo-2H-1,3-benzodioxol-5-yl)methyl]-2,4,5,6-tetrahydro-1H-indol-2-one
Other name (1)：
  • 1-(6-Bromo-1,3-benzodioxole-5-ylmethyl)-1,4,5,6-tetrahydro-2H-indole-2-one
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