Chem
J-GLOBAL ID：201007059483199053   Nikkaji number：J2.889.752I

6,13-Dibromo-2,9-bis[3-(9-anthryl)propyl]-1,2,3,8,9,10-hexahydroanthra[2,1,9-def:6,5,10-d′e′f′]diisoquinoline-1,3,8,10-tetraone

6,13-ジブロモ-2,9-ビス[3-(9-アントリル)プロピル]-1,2,3,8,9,10-ヘキサヒドロアントラ[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
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： C58H36Br2N2O4
Molecular formula furigana： C58-H36-BR2-N2-O4
Molecular weight： 984.744
InChI： InChI=1S/C58H36Br2N2O4/c59-47-29-45-49-43(55(63)61(57(45)65)25-9-19-39-35-15-5-1-11-31(35)27-32-12-2-6-16-36(32)39)23-21-41-52-48(60)30-46-50-44(24-22-42(54(50)52)51(47)53(41)49)56(64)62(58(46)66)26-10-20-40-37-17-7-3-13-33(37)28-34-14-4-8-18-38(34)40/h1-8,11-18,21-24,27-30H,9-10,19-20,25-26H2
InChI key： IFTUCMKCCIQAPP-UHFFFAOYSA-N
SMILES： Brc1cc2c3c(ccc4c5c(Br)cc6c7c(ccc(c1c34)c57)c(=O)n(CCCc1c3ccccc3cc3ccccc13)c6=O)c(=O)n(CCCc1c3ccccc3cc3ccccc13)c2=O
Systematic name  (3)：
  • 6,13-ジブロモ-2,9-ビス[3-(9-アントリル)プロピル]-1,2,3,8,9,10-ヘキサヒドロアントラ[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
  • 7,18-ビス[3-(アントラセン-9-イル)プロピル]-11,22-ジブロモ-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-6,8,17,19-テトラオン
  • 7,18-bis[3-(anthracen-9-yl)propyl]-11,22-dibromo-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-6,8,17,19-tetrone
Other name (1)：
  • 6,13-Dibromo-2,9-bis[3-(9-anthryl)propyl]-1,2,3,8,9,10-hexahydroanthra[2,1,9-def:6,5,10-d′e′f′]diisoquinoline-1,3,8,10-tetraone
Thsaurus map：
Thesaurus Map

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