Chem
J-GLOBAL ID：200907085992058558
Nikkaji number：J1.565.349C
(3R)-1-Benzyl-3α-chloro-3aα-phenyl-2,3,3a,4,5,6-hexahydro-1H-indole-2-one
(3R)-1-ベンジル-3α-クロロ-3aα-フェニル-2,3,3a,4,5,6-ヘキサヒドロ-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： C21H20ClNO
Molecular formula furigana： C21-H20-CL-N-O
Molecular weight： 337.850
InChI：
InChI=1S/C21H20ClNO/c22-19-20(24)23(15-16-9-3-1-4-10-16)18-13-7-8-14-21(18,19)17-11-5-2-6-12-17/h1-6,9-13,19H,7-8,14-15H2/t19-,21+/m0/s1
InChI key：
LHCLCAHEMLYZPG-PZJWPPBQSA-N
SMILES：
Cl[C@H]1C(=O)N(Cc2ccccc2)C2=CCCC[C@]12c1ccccc1
Systematic name (4)：
- (3R,3aR)-1-ベンジル-3-クロロ-3a-フェニル-3a,4,5,6-テトラヒドロ-1H-インドール-2(3H)-オン
- (3R)-1-ベンジル-3α-クロロ-3aα-フェニル-2,3,3a,4,5,6-ヘキサヒドロ-1H-インドール-2-オン
- (3R,3aR)-1-ベンジル-3-クロロ-3a-フェニル-2,3,3a,4,5,6-ヘキサヒドロ-1H-インドール-2-オン
- (3R,3aR)-1-benzyl-3-chloro-3a-phenyl-2,3,3a,4,5,6-hexahydro-1H-indol-2-one
- (3R,3aR)-1-Benzyl-3-chloro-3a-phenyl-3a,4,5,6-tetrahydro-1H-indole-2(3H)-one
- (3R)-1-Benzyl-3α-chloro-3aα-phenyl-2,3,3a,4,5,6-hexahydro-1H-indole-2-one
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