Chem
J-GLOBAL ID：201807006942796674   Nikkaji number：J3.724.203I

2-[(tert-Butylimino)methyl]-4-[(1-pyrenyl)methyl]benzenesulfinic acid

2-[(tert-ブチルイミノ)メチル]-4-[(1-ピレニル)メチル]ベンゼンスルフィン酸
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： C28H25NO2S
Molecular formula furigana： C28-H25-N-O2-S
Molecular weight： 439.570
InChI： InChI=1S/C28H25NO2S/c1-28(2,3)29-17-23-16-18(7-14-25(23)32(30)31)15-22-11-10-21-9-8-19-5-4-6-20-12-13-24(22)27(21)26(19)20/h4-14,16-17H,15H2,1-3H3,(H,30,31)
InChI key： GJEUSJWNOWGAHY-UHFFFAOYSA-N
SMILES： CC(C)(C)N=Cc1cc(Cc2ccc3ccc4cccc5ccc2c3c45)ccc1S(=O)O
Systematic name  (3)：
  • 2-[(tert-ブチルイミノ)メチル]-4-[(1-ピレニル)メチル]ベンゼンスルフィン酸
  • 2-[(tert-ブチルイミノ)メチル]-4-[(ピレン-1-イル)メチル]ベンゼン-1-スルフィン酸
  • 2-[(tert-butylimino)methyl]-4-[(pyren-1-yl)methyl]benzene-1-sulfinic acid
Other name (1)：
  • 2-[(tert-Butylimino)methyl]-4-[(1-pyrenyl)methyl]benzenesulfinic acid
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