Chem
J-GLOBAL ID：201207027986287133   Nikkaji number：J3.101.281C

2,3,8,9,14,15-Hexabutoxy-5,6,11,12,17,18-hexadehydrotribenzo[a,e,i]cyclododecene

2,3,8,9,14,15-ヘキサブトキシ-5,6,11,12,17,18-ヘキサデヒドロトリベンゾ[a,e,i]シクロドデセン
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： C48H60O6
Molecular formula furigana： C48-H60-O6
Molecular weight： 733.002
InChI： InChI=1S/C48H60O6/c1-7-13-25-49-43-31-37-19-20-39-33-45(51-27-15-9-3)47(53-29-17-11-5)35-41(39)23-24-42-36-48(54-30-18-12-6)46(52-28-16-10-4)34-40(42)22-21-38(37)32-44(43)50-26-14-8-2/h31-36H,7-18,25-30H2,1-6H3
InChI key： PDEPFEXHBWOUOT-UHFFFAOYSA-N
SMILES： CCCCOc1cc2C#Cc3cc(OCCCC)c(OCCCC)cc3C#Cc3cc(OCCCC)c(OCCCC)cc3C#Cc2cc1OCCCC
Systematic name  (4)：
  • 1,2-(4,5-ジブトキシベンゼン-1,2-ジイル)ビス[(エチン-1,2-ジイル)(4,5-ジブトキシ-1,2-フェニレン)]エチン
  • 2,3,8,9,14,15-ヘキサブトキシ-5,6,11,12,17,18-ヘキサデヒドロトリベンゾ[a,e,i]シクロドデセン
  • 6,7,14,15,22,23-ヘキサブトキシテトラシクロ[18.4.0.04,9.012,17]テトラコサ-1(20),4,6,8,12,14,16,21,23-ノナエン-2,10,18-トリイン
  • 6,7,14,15,22,23-hexabutoxytetracyclo[18.4.0.04,9.012,17]tetracosa-1(20),4,6,8,12,14,16,21,23-nonaen-2,10,18-triyne
Other name (2)：
  • 1,2-(4,5-Dibutoxybenzene-1,2-diyl)bis[(ethyne-1,2-diyl)(4,5-dibutoxy-1,2-phenylene)]ethyne
  • 2,3,8,9,14,15-Hexabutoxy-5,6,11,12,17,18-hexadehydrotribenzo[a,e,i]cyclododecene
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