Chem
J-GLOBAL ID：200907020033138718   Nikkaji number：J1.814.335F

3,2-(1,3-Pentadienyl-5-ylidene)-4,5-(1,3-pentadienyl-5-ylidene)-7,8,9,10-tetraphenyl-2,5-dihydrobenzo[e]-as-indacene-1,6-dicarboxylic acid dimethyl ester

3,2-(1,3-ペンタジエニル-5-イリデン)-4,5-(1,3-ペンタジエニル-5-イリデン)-7,8,9,10-テトラフェニル-2,5-ジヒドロベンゾ[e]-as-インダセン-1,6-ジカルボン酸ジメチル
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： C54H36O4
Molecular formula furigana： C54-H36-O4
Molecular weight： 748.878
InChI： InChI=1S/C54H36O4/c1-57-53(55)47-39-31-19-7-17-29-37(39)45-46-38-30-18-8-20-32-40(38)48(54(56)58-2)52(46)50-44(36-27-15-6-16-28-36)42(34-23-11-4-12-24-34)41(33-21-9-3-10-22-33)43(49(50)51(45)47)35-25-13-5-14-26-35/h3-32H,1-2H3
InChI key： GACOHDZKTYHHCJ-UHFFFAOYSA-N
SMILES： COC(=O)c1c2cccccc2c2c1c1c(c3ccccc3)c(c3ccccc3)c(c3ccccc3)c(c3ccccc3)c1c1c(C(=O)OC)c3cccccc3c21
Systematic name  (3)：
  • 3,2-(1,3-ペンタジエニル-5-イリデン)-4,5-(1,3-ペンタジエニル-5-イリデン)-7,8,9,10-テトラフェニル-2,5-ジヒドロベンゾ[e]-as-インダセン-1,6-ジカルボン酸ジメチル
  • 10,19-ジメチル 13,14,15,16-テトラフェニルヘキサシクロ[16.8.0.02,11.03,9.012,17.020,26]ヘキサコサ-1(26),2,4,6,8,10,12,14,16,18,20,22,24-トリデカエン-10,19-ジカルボキシラート
  • 10,19-dimethyl 13,14,15,16-tetraphenylhexacyclo[16.8.0.02,11.03,9.012,17.020,26]hexacosa-1(26),2,4,6,8,10,12,14,16,18,20,22,24-tridecaene-10,19-dicarboxylate
Other name (1)：
  • 3,2-(1,3-Pentadienyl-5-ylidene)-4,5-(1,3-pentadienyl-5-ylidene)-7,8,9,10-tetraphenyl-2,5-dihydrobenzo[e]-as-indacene-1,6-dicarboxylic acid dimethyl ester
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