Chem
J-GLOBAL ID：201907004996588729
Nikkaji number：J3.739.530G
(7aS)-7a-iodo-1-(4-methylbenzenesulfonyl)-4,5-dihydro-2H-indole
(7aS)-7a-ヨード-1-(4-メチルベンゼンスルホニル)-4,5-ジヒドロ-2H-インドール
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： C15H16INO2S
Molecular formula furigana： C15-H16-I-N-O2-S
Molecular weight： 401.260
InChI：
InChI=1S/C15H16INO2S/c1-12-5-7-14(8-6-12)20(18,19)17-11-9-13-4-2-3-10-15(13,17)16/h3,5-10H,2,4,11H2,1H3/t15-/m1/s1
InChI key：
SXLSMQVFHYVKDU-OAHLLOKOSA-N
SMILES：
C1C=C2CCC=C[C@]2(N1S(=O)(=O)c1ccc(cc1)C)I
Systematic name (3)：
- (S)-1-トシル-7a-ヨード-2,4,5,7a-テトラヒドロ-1H-インドール
- (7aS)-7a-ヨード-1-(4-メチルベンゼンスルホニル)-2,4,5,7a-テトラヒドロ-1H-インドール
- (7aS)-7a-iodo-1-(4-methylbenzenesulfonyl)-2,4,5,7a-tetrahydro-1H-indole
- (7aS)-7a-ヨード-1-(4-メチルベンゼンスルホニル)-4,5-ジヒドロ-2H-インドール
- (7aS)-7a-iodo-1-(4-methylbenzenesulfonyl)-4,5-dihydro-2H-indole
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