Chem
J-GLOBAL ID：201307092778465943   Nikkaji number：J3.184.458D

3-(1,1,7,7-Tetraethyl-1,2,3,5,6,7-hexahydro-3,3,5,5-tetramethyl-s-indacene-4-yl)thiophene 1-oxide

3-(1,1,7,7-テトラエチル-1,2,3,5,6,7-ヘキサヒドロ-3,3,5,5-テトラメチル-s-インダセン-4-イル)チオフェン1-オキシド
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： C28H40[O-][S+]
Molecular formula furigana： C28-H40-O-S
Molecular weight： 424.690
InChI： InChI=1S/C28H40OS/c1-9-27(10-2)17-25(5,6)23-20(27)15-21-24(22(23)19-13-14-30(29)16-19)26(7,8)18-28(21,11-3)12-4/h13-16H,9-12,17-18H2,1-8H3
InChI key： PHJMXRSRAGTNHN-UHFFFAOYSA-N
SMILES： CCC1(CC)CC(C)(C)c2c1cc1c(c2C2=C[S+]([O-])C=C2)C(C)(C)CC1(CC)CC
Systematic name  (4)：
  • 3-(1,1,7,7-テトラエチル-3,3,5,5-テトラメチル-1,2,3,5,6,7-ヘキサヒドロ-s-インダセン-4-イル)チオフェン1-オキシド
  • 3-(1,1,7,7-テトラエチル-1,2,3,5,6,7-ヘキサヒドロ-3,3,5,5-テトラメチル-s-インダセン-4-イル)チオフェン1-オキシド
  • 3-(1,1,7,7-テトラエチル-3,3,5,5-テトラメチル-1,2,3,5,6,7-ヘキサヒドロ-s-インダセン-4-イル)-1H-チオフェン-1-イウム-1-オラート
  • 3-(1,1,7,7-tetraethyl-3,3,5,5-tetramethyl-1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-1H-thiophen-1-ium-1-olate
Other name (2)：
  • 3-(1,1,7,7-Tetraethyl-3,3,5,5-tetramethyl-1,2,3,5,6,7-hexahydro-s-indacene-4-yl)thiophene 1-oxide
  • 3-(1,1,7,7-Tetraethyl-1,2,3,5,6,7-hexahydro-3,3,5,5-tetramethyl-s-indacene-4-yl)thiophene 1-oxide
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