Chem
J-GLOBAL ID:200907005861255524   Nikkaji number:J2.625.696H

1-Acetyl-2-oxo-3-(1,1-dimethyl-2-propenyl)-6-bromo-2,3-dihydro-1H-indole-3-acetonitrile

1-アセチル-2-オキソ-3-(1,1-ジメチル-2-プロペニル)-6-ブロモ-2,3-ジヒドロ-1H-インドール-3-アセトニトリル
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: C17H17BrN2O2
Molecular formula furigana: C17-H17-BR-N2-O2
Molecular weight: 361.239
InChI: InChI=1S/C17H17BrN2O2/c1-5-16(3,4)17(8-9-19)13-7-6-12(18)10-14(13)20(11(2)21)15(17)22/h5-7,10H,1,8H2,2-4H3
InChI key: CTFGOPVJURTKOY-UHFFFAOYSA-N
SMILES: CC(=O)N1C(=O)C(CC#N)(c2ccc(Br)cc12)C(C)(C)C=C
Systematic name  (3):
  • 1-アセチル-2-オキソ-3-(1,1-ジメチル-2-プロペニル)-6-ブロモ-2,3-ジヒドロ-1H-インドール-3-アセトニトリル
  • 2-[1-アセチル-6-ブロモ-3-(2-メチルブタ-3-エン-2-イル)-2-オキソ-2,3-ジヒドロ-1H-インドール-3-イル]アセトニトリル
  • 2-[1-acetyl-6-bromo-3-(2-methylbut-3-en-2-yl)-2-oxo-2,3-dihydro-1H-indol-3-yl]acetonitrile
Other name (1):
  • 1-Acetyl-2-oxo-3-(1,1-dimethyl-2-propenyl)-6-bromo-2,3-dihydro-1H-indole-3-acetonitrile
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