Chem
J-GLOBAL ID：200907066860157714   Nikkaji number：J2.580.655G

1-Tosyl-4-(4-nitrophenylsulfonyl)-2,3,3a,4,5,6-hexahydro-1H-pyrrolo[3,2-b]pyridine

1-トシル-4-(4-ニトロフェニルスルホニル)-2,3,3a,4,5,6-ヘキサヒドロ-1H-ピロロ[3,2-b]ピリジン
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： C20H21N2[N+]O5[O-]S2
Molecular formula furigana： C20-H21-N3-O6-S2
Molecular weight： 463.520
InChI： InChI=1S/C20H21N3O6S2/c1-15-4-8-17(9-5-15)31(28,29)22-14-12-20-19(22)3-2-13-21(20)30(26,27)18-10-6-16(7-11-18)23(24)25/h3-11,20H,2,12-14H2,1H3
InChI key： VMGRLZPDASFVCG-UHFFFAOYSA-N
SMILES： Cc1ccc(cc1)S(=O)(=O)N1CCC2N(CCC=C12)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
Systematic name  (3)：
  • 1-トシル-4-(4-ニトロフェニルスルホニル)-2,3,3a,4,5,6-ヘキサヒドロ-1H-ピロロ[3,2-b]ピリジン
  • 1-(4-メチルベンゼンスルホニル)-4-(4-ニトロベンゼンスルホニル)-1H,2H,3H,3aH,4H,5H,6H-ピロロ[3,2-b]ピリジン
  • 1-(4-methylbenzenesulfonyl)-4-(4-nitrobenzenesulfonyl)-1H,2H,3H,3aH,4H,5H,6H-pyrrolo[3,2-b]pyridine
Other name (1)：
  • 1-Tosyl-4-(4-nitrophenylsulfonyl)-2,3,3a,4,5,6-hexahydro-1H-pyrrolo[3,2-b]pyridine
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