Chem
J-GLOBAL ID:200907090649597110   Nikkaji number:J1.561.386F

3-Dodecyl-5,13-didecyl-9-(2,6-diisopropylphenyl)-9-aza-10H-benzo[bc]coronene-8,10(9H)-dione

3-ドデシル-5,13-ジデシル-9-(2,6-ジイソプロピルフェニル)-9-アザ-10H-ベンゾ[bc]コロネン-8,10(9H)-ジオン
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: C70H91NO2
Molecular formula furigana: C70-H91-N-O2
Molecular weight: 978.503
InChI: InChI=1S/C70H91NO2/c1-8-11-14-17-20-23-24-27-30-33-37-51-44-58-50(36-32-29-26-22-19-16-13-10-3)43-53-46-60-63-59(69(72)71(70(60)73)68-54(47(4)5)38-34-39-55(68)48(6)7)45-52-42-49(35-31-28-25-21-18-15-12-9-2)56-40-41-57(51)65-64(56)61(52)67(63)62(53)66(58)65/h34,38-48H,8-33,35-37H2,1-7H3
InChI key: PBHZZORWDGOLHW-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCc1cc2c(CCCCCCCCCC)cc3cc4c5c(cc6cc(CCCCCCCCCC)c7ccc1c1c7c6c5c3c21)c(=O)n(c1c(cccc1C(C)C)C(C)C)c4=O
Systematic name  (3):
  • 3-ドデシル-5,13-ジデシル-9-(2,6-ジイソプロピルフェニル)-9-アザ-10H-ベンゾ[bc]コロネン-8,10(9H)-ジオン
  • 17-[2,6-ビス(プロパン-2-イル)フェニル]-3,11-ビス(デシル)-6-ドデシル-17-アザオクタシクロ[17.7.1.04,25.07,24.010,23.013,22.015,20.021,26]ヘプタコサ-1,3,5,7(24),8,10,12,14,19(27),20,22,25-ドデカエン-16,18-ジオン
  • 17-[2,6-bis(propan-2-yl)phenyl]-3,11-bis(decyl)-6-dodecyl-17-azaoctacyclo[17.7.1.04,25.07,24.010,23.013,22.015,20.021,26]heptacosa-1,3,5,7(24),8,10,12,14,19(27),20,22,25-dodecaene-16,18-dione
Other name (1):
  • 3-Dodecyl-5,13-didecyl-9-(2,6-diisopropylphenyl)-9-aza-10H-benzo[bc]coronene-8,10(9H)-dione
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