Chem
J-GLOBAL ID：200907011236028510   Nikkaji number：J1.349.415K

N,N′-Bis[2-[7-(1,3-dioxo-1,3-dihydro-2H-benzo[de]isoquinoline-2-yl)heptanoylamino]phenyl]perylene-3,4:9,10-bis(dicarbimide)

N,N′-ビス[2-[7-(1,3-ジオキソ-1,3-ジヒドロ-2H-ベンゾ[de]イソキノリン-2-イル)ヘプタノイルアミノ]フェニル]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： C74H54N6O10
Molecular formula furigana： C74-H54-N6-O10
Molecular weight： 1187.278
InChI： InChI=1S/C74H54N6O10/c81-59(29-5-1-3-11-39-77-67(83)47-21-13-17-41-18-14-22-48(61(41)47)68(77)84)75-55-25-7-9-27-57(55)79-71(87)51-35-31-43-45-33-37-53-66-54(38-34-46(64(45)66)44-32-36-52(72(79)88)65(51)63(43)44)74(90)80(73(53)89)58-28-10-8-26-56(58)76-60(82)30-6-2-4-12-40-78-69(85)49-23-15-19-42-20-16-24-50(62(42)49)70(78)86/h7-10,13-28,31-38H,1-6,11-12,29-30,39-40H2,(H,75,81)(H,76,82)
InChI key： BAKJIOYIJFNBGN-UHFFFAOYSA-N
SMILES： O=C(CCCCCCn1c(=O)c2cccc3cccc(c1=O)c23)Nc1ccccc1n1c(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)c1=O)c46)c(=O)n(c1ccccc1NC(=O)CCCCCCn1c(=O)c2cccc3cccc(c1=O)c23)c5=O
Systematic name  (4)：
  • N,N′-ビス[2-[7-(1,3-ジオキソ-1,3-ジヒドロ-2H-ベンゾ[de]イソキノリン-2-イル)ヘプタノイルアミノ]フェニル]ペリレン-3,4:9,10-ビス(ジカルボイミド)
  • 2,9-ビス[2-[[1-オキソ-7-(2,3-ジヒドロ-1,3-ジオキソ-1H-ベンゾ[de]イソキノリン-2-イル)ヘプチル]アミノ]フェニル]-2H,9H-アントラ[2,1,9-def:6,5,10-d′e′f′]ジイソキノリン-1,3,8,10-テトラオン
  • 7-{2,4-ジオキソ-3-アザトリシクロ[7.3.1.05,13]トリデカ-1(13),5,7,9,11-ペンタエン-3-イル}-N-(2-{18-[2-(7-{2,4-ジオキソ-3-アザトリシクロ[7.3.1.05,13]トリデカ-1(13),5,7,9,11-ペンタエン-3-イル}ヘプタンアミド)フェニル]-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-7-イル}フェニル)ヘプタンアミド
  • 7-{2,4-dioxo-3-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-3-yl}-N-(2-{18-[2-(7-{2,4-dioxo-3-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-3-yl}heptanamido)phenyl]-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-decaen-7-yl}phenyl)heptanamide
Other name (2)：
  • N,N′-Bis[2-[7-(1,3-dioxo-1,3-dihydro-2H-benzo[de]isoquinoline-2-yl)heptanoylamino]phenyl]perylene-3,4:9,10-bis(dicarbimide)
  • 2,9-Bis[2-[[1-oxo-7-(2,3-dihydro-1,3-dioxo-1H-benzo[de]isoquinoline-2-yl)heptyl]amino]phenyl]-2H,9H-anthra[2,1,9-def:6,5,10-d′e′f′]diisoquinoline-1,3,8,10-tetrone
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