Chem
J-GLOBAL ID：202407006503237844
Nikkaji number：J3.806.883K
12,13,28,29-テトラフルオロ-9,16,25,32-テトラアザヘプタシクロ[22.8.0.02,7.08,17.010,15.018,23.026,31]ドトリアコンタ-1(32),2(7),3,5,8,10(15),11,13,16,18(23),19,21,24,26(31),27,29-ヘキサデカエン
12,13,28,29-テトラフルオロ-9,16,25,32-テトラアザヘプタシクロ[22.8.0.02,7.08,17.010,15.018,23.026,31]ドトリアコンタ-1(32),2(7),3,5,8,10(15),11,13,16,18(23),19,21,24,26(31),27,29-ヘキサデカエン
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
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
Molecular formula： C28H12F4N4
Molecular formula furigana： C28-H12-F4-N4
Molecular weight： 480.426
InChI：
InChI=1S/C28H12F4N4/c29-17-9-21-22(10-18(17)30)35-27-15-7-3-4-8-16(15)28-26(14-6-2-1-5-13(14)25(27)33-21)34-23-11-19(31)20(32)12-24(23)36-28/h1-12H/b25-13+,26-14+,27-15+,28-16+
InChI key：
ZZNPLKUJODZMGO-BRJCPHQQSA-N
SMILES：
c12c3c(c4c(c5c(c1nc1c(n2)cc(c(c1)F)F)cccc5)nc1c(n4)cc(c(c1)F)F)cccc3
Systematic name (2)：
- 12,13,28,29-テトラフルオロ-9,16,25,32-テトラアザヘプタシクロ[22.8.0.02,7.08,17.010,15.018,23.026,31]ドトリアコンタ-1(32),2(7),3,5,8,10(15),11,13,16,18(23),19,21,24,26(31),27,29-ヘキサデカエン
- 12,13,28,29-tetrafluoro-9,16,25,32-tetraazaheptacyclo[22.8.0.02,7.08,17.010,15.018,23.026,31]dotriaconta-1(32),2(7),3,5,8,10(15),11,13,16,18(23),19,21,24,26(31),27,29-hexadecaene
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