Chem
J-GLOBAL ID：200907001502996637   Nikkaji number：J2.444.432E

2-Tosyl-2,3,3aα,6-tetrahydro-6β-methyl-8-[(benzyloxy)methyl]-1H-cycloocta[c]pyrrole

2-トシル-2,3,3aα,6-テトラヒドロ-6β-メチル-8-[(ベンジルオキシ)メチル]-1H-シクロオクタ[c]ピロール
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： C26H29NO3S
Molecular formula furigana： C26-H29-N-O3-S
Molecular weight： 435.580
InChI： InChI=1S/C26H29NO3S/c1-20-9-12-26(13-10-20)31(28,29)27-16-24-11-8-21(2)14-23(15-25(24)17-27)19-30-18-22-6-4-3-5-7-22/h3-15,21,24H,16-19H2,1-2H3/b11-8?,23-14?,25-15-/t21-,24-/m1/s1
InChI key： ZZJIICIZNONFKB-FXEKWHALSA-N
SMILES： C[C@@H]1C=C[C@@H]2CN(CC2=CC(=C1)COCc1ccccc1)S(=O)(=O)c1ccc(C)cc1
Systematic name  (3)：
  • 2-トシル-2,3,3aα,6-テトラヒドロ-6β-メチル-8-[(ベンジルオキシ)メチル]-1H-シクロオクタ[c]ピロール
  • (3aS,6R)-8-[(ベンジルオキシ)メチル]-6-メチル-2-(4-メチルベンゼンスルホニル)-1H,2H,3H,3aH,6H-シクロオクタ[c]ピロール
  • (3aS,6R)-8-[(benzyloxy)methyl]-6-methyl-2-(4-methylbenzenesulfonyl)-1H,2H,3H,3aH,6H-cycloocta[c]pyrrole
Other name (1)：
  • 2-Tosyl-2,3,3aα,6-tetrahydro-6β-methyl-8-[(benzyloxy)methyl]-1H-cycloocta[c]pyrrole
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