Chem
J-GLOBAL ID：200907038598761008
Nikkaji number：J2.347.928A
(3aα,7aα)-1-Benzyl-3,3-dichlorooctahydro-1H-indole-2-one
(3aα,7aα)-1-ベンジル-3,3-ジクロロオクタヒドロ-1H-インドール-2-オン
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
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
Molecular formula： C15H17Cl2NO
Molecular formula furigana： C15-H17-CL2-N-O
Molecular weight： 298.210
InChI：
InChI=1S/C15H17Cl2NO/c16-15(17)12-8-4-5-9-13(12)18(14(15)19)10-11-6-2-1-3-7-11/h1-3,6-7,12-13H,4-5,8-10H2/t12-,13+/m0/s1
InChI key：
GUQMSICOKHSEFI-QWHCGFSZSA-N
SMILES：
ClC1(Cl)[C@H]2CCCC[C@H]2N(Cc2ccccc2)C1=O
Systematic name (3)：
- (3aα,7aα)-1-ベンジル-3,3-ジクロロオクタヒドロ-1H-インドール-2-オン
- (3aS,7aR)-1-ベンジル-3,3-ジクロロ-オクタヒドロ-1H-インドール-2-オン
- (3aS,7aR)-1-benzyl-3,3-dichloro-octahydro-1H-indol-2-one
- (3aα,7aα)-1-Benzyl-3,3-dichlorooctahydro-1H-indole-2-one
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