Chem
J-GLOBAL ID：201807002557401736   Nikkaji number：J3.725.074K

9,9′-[4-Methoxyphenyliminobis(p-phenylene)bis(4-butoxyphenylimino)]-10,10′-[4-methoxyphenyliminobis(p-phenylene)bis(4-butoxyphenylimino)]dianthracene

9,9′-[4-メトキシフェニルイミノビス(p-フェニレン)ビス(4-ブトキシフェニルイミノ)]-10,10′-[4-メトキシフェニルイミノビス(p-フェニレン)ビス(4-ブトキシフェニルイミノ)]ジアントラセン
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： C106H98N6O6
Molecular formula furigana： C106-H98-N6-O6
Molecular weight： 1551.986
InChI： InChI=1S/C106H98N6O6/c1-7-11-71-115-91-63-51-85(52-64-91)109-81-39-31-75(32-40-81)107(79-47-59-89(113-5)60-48-79)76-33-43-83(44-34-76)111(87-55-67-93(68-56-87)117-73-13-9-3)105-99-27-19-21-29-101(99)106(102-30-22-20-28-100(102)105)112(88-57-69-94(70-58-88)118-74-14-10-4)84-45-37-78(38-46-84)108(80-49-61-90(114-6)62-50-80)77-35-41-82(42-36-77)110(86-53-65-92(66-54-86)116-72-12-8-2)104-97-25-17-15-23-95(97)103(109)96-24-16-18-26-98(96)104/h15-70H,7-14,71-74H2,1-6H3
InChI key： BSAODQONXONHIB-UHFFFAOYSA-N
SMILES： CCCCOc1ccc(cc1)N1c2ccc(cc2)N(c2ccc(OC)cc2)c2ccc(cc2)N(c2ccc(OCCCC)cc2)c2c3ccccc3c(N(c3ccc(OCCCC)cc3)c3ccc(cc3)N(c3ccc(OC)cc3)c3ccc(cc3)N(c3ccc(OCCCC)cc3)c3c4ccccc4c1c1ccccc31)c1ccccc21
Systematic name  (3)：
  • 9,9′-[4-メトキシフェニルイミノビス(p-フェニレン)ビス(4-ブトキシフェニルイミノ)]-10,10′-[4-メトキシフェニルイミノビス(p-フェニレン)ビス(4-ブトキシフェニルイミノ)]ジアントラセン
  • 2,12,21,31-テトラキス(4-ブトキシフェニル)-7,26-ビス(4-メトキシフェニル)-2,7,12,21,26,31-ヘキサアザウンデカシクロ[30.6.6.613,20.23,6.28,11.222,25.227,30.014,19.033,38.039,44.049,54]オクタペンタコンタ-1(38),3,5,8,10,13,15,17,19,22,24,27,29,32,34,36,39,41,43,45,47,49,51,53,55,57-ヘキサコサエン
  • 2,12,21,31-tetrakis(4-butoxyphenyl)-7,26-bis(4-methoxyphenyl)-2,7,12,21,26,31-hexaazaundecacyclo[30.6.6.613,20.23,6.28,11.222,25.227,30.014,19.033,38.039,44.049,54]octapentaconta-1(38),3,5,8,10,13,15,17,19,22,24,27,29,32,34,36,39,41,43,45,47,49,51,53,55,57-hexacosaene
Other name (1)：
  • 9,9′-[4-Methoxyphenyliminobis(p-phenylene)bis(4-butoxyphenylimino)]-10,10′-[4-methoxyphenyliminobis(p-phenylene)bis(4-butoxyphenylimino)]dianthracene
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