Chem
J-GLOBAL ID：200907088406173130   Nikkaji number：J146.160E

7-Chloro-4,6-dimethoxy-6′-methyl-2′-(methylthio)spiro[benzofuran-2(3H),1′-[2]cyclohexene]-3,4′-dione

スピロ[ベンゾフラン-2(3H),1′-[2]シクロヘキセン]-7-クロロ-4,6-ジメトキシ-6′-メチル-2′-(メチルチオ)-3,4′-ジオン
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： C17H17ClO5S
Molecular formula furigana： C17-H17-CL-O5-S
Molecular weight： 368.830
InChI： InChI=1S/C17H17ClO5S/c1-8-5-9(19)6-12(24-4)17(8)16(20)13-10(21-2)7-11(22-3)14(18)15(13)23-17/h6-8H,5H2,1-4H3
InChI key： DCCZLOASKLQMQQ-UHFFFAOYSA-N
SMILES： COc1cc(OC)c(Cl)c2OC3(C(C)CC(=O)C=C3SC)C(=O)c12
Systematic name  (3)：
  • 7-クロロ-4,6-ジメトキシ-6′-メチル-2′-(メチルチオ)スピロ[ベンゾフラン-2(3H),1′-[2]シクロヘキセン]-3,4′-ジオン
  • 7-クロロ-4,6-ジメトキシ-6'-メチル-2'-(メチルスルファニル)-3H-スピロ[1-ベンゾフラン-2,1'-シクロヘキサン]-2'-エン-3,4'-ジオン
  • 7-chloro-4,6-dimethoxy-6'-methyl-2'-(methylsulfanyl)-3H-spiro[1-benzofuran-2,1'-cyclohexan]-2'-ene-3,4'-dione
Other name (3)：
  • 7-Chloro-4,6-dimethoxy-6′-methyl-2′-(methylthio)spiro[benzofuran-2(3H),1′-[2]cyclohexene]-3,4′-dione
  • Spiro[benzofuran-2(3H),1′-[2]cyclohexene]-7-chloro-4,6-dimethoxy-6′-methyl-2′-(methylthio)-3,4′-dione
  • スピロ[ベンゾフラン-2(3H),1′-[2]シクロヘキセン]-7-クロロ-4,6-ジメトキシ-6′-メチル-2′-(メチルチオ)-3,4′-ジオン
CAS registry number： 26881-62-9
KEGG COMPOUND： C15300
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