Chem
J-GLOBAL ID：201207041357312217   Nikkaji number：J3.022.578C

N,N′-Bis[3-(10-octyl-9-anthryl)propyl]-1,7-dicyanoperylene-3,4:9,10-bis(dicarbimide)

N,N′-ビス[3-(10-オクチル-9-アントリル)プロピル]-1,7-ジシアノペリレン-3,4:9,10-ビス(ジカルボイミド)
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： C76H68N4O4
Molecular formula furigana： C76-H68-N4-O4
Molecular weight： 1101.404
InChI： InChI=1S/C76H68N4O4/c1-3-5-7-9-11-13-25-49-51-27-15-19-31-55(51)59(56-32-20-16-28-52(49)56)35-23-41-79-73(81)63-39-37-61-68-48(46-78)44-66-70-64(40-38-62(72(68)70)67-47(45-77)43-65(75(79)83)69(63)71(61)67)74(82)80(76(66)84)42-24-36-60-57-33-21-17-29-53(57)50(26-14-12-10-8-6-4-2)54-30-18-22-34-58(54)60/h15-22,27-34,37-40,43-44H,3-14,23-26,35-36,41-42H2,1-2H3
InChI key： IKHVQYWVDQCZKW-UHFFFAOYSA-N
SMILES： CCCCCCCCc1c2ccccc2c(CCCn2c(=O)c3ccc4c5c(cc6c7c(ccc(c8c(cc(c3c48)c2=O)C#N)c57)c(=O)n(CCCc2c3ccccc3c(CCCCCCCC)c3ccccc23)c6=O)C#N)c2ccccc12
Systematic name  (3)：
  • N,N′-ビス[3-(10-オクチル-9-アントリル)プロピル]-1,7-ジシアノペリレン-3,4:9,10-ビス(ジカルボイミド)
  • 7,18-ビス[3-(10-オクチルアントラセン-9-イル)プロピル]-6,8,17,19-テトラオキソ-7,18-ジアザヘプタシクロ[14.6.2.22,5.03,12.04,9.013,23.020,24]ヘキサコサ-1(22),2(26),3,5(25),9,11,13,15,20,23-デカエン-11,22-ジカルボニトリル
  • 7,18-bis[3-(10-octylanthracen-9-yl)propyl]-6,8,17,19-tetraoxo-7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(22),2(26),3,5(25),9,11,13,15,20,23-decaene-11,22-dicarbonitrile
Other name (1)：
  • N,N′-Bis[3-(10-octyl-9-anthryl)propyl]-1,7-dicyanoperylene-3,4:9,10-bis(dicarbimide)
Thsaurus map：
Thesaurus Map

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