Chem
J-GLOBAL ID：201107068084227520   Nikkaji number：J2.956.420E

4,4-Difluoro-8-(3,4-dinitrophenyl)-1,3,5,7-tetramethyl-3a-azonia-4a-aza-4-bora(IV)-s-indacene

4,4-ジフルオロ-8-(3,4-ジニトロフェニル)-1,3,5,7-テトラメチル-3a-アゾニア-4a-アザ-4-ボラ(IV)-s-インダセン
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： C19H17BF2N[N+]3O2[O-]2
Molecular formula furigana： C19-H17-B-F2-N4-O4
Molecular weight： 414.180
InChI： InChI=1S/C19H17BF2N4O4/c1-10-7-12(3)23-18(10)17(19-11(2)8-13(4)24(19)20(23,21)22)14-5-6-15(25(27)28)16(9-14)26(29)30/h5-9H,1-4H3/q+1
InChI key： CBZRZIHHUFOBOW-UHFFFAOYSA-N
SMILES： CC1=CC(=[N+]2C1=C(c1c(C)cc(C)n1[B]2(F)F)c1ccc(c(c1)[N+](=O)[O-])[N+](=O)[O-])C
Systematic name  (5)：
  • 4,4-ジフルオロ-8-(3,4-ジニトロフェニル)-1,3,5,7-テトラメチル-3a-アゾニア-4a-アザ-4-ボラ(IV)-s-インダセン
  • 4,4-ジフルオロ-1,3,5,7-テトラメチル-8-(3,4-ジニトロフェニル)-4H-3a-アザ-4a-アゾニア-4-ボラ(IV)-s-インダセン
  • 8-(3,4-ジニトロフェニル)-4,4-ジフルオロ-1,3,5,7-テトラメチル-3a-アザ-4a-アゾニア-4-ボラ(IV)-s-インダセン
  • 8-(3,4-ジニトロフェニル)-2,2-ジフルオロ-4,6,10,12-テトラメチル-1λ5,3-ジアザ-2λ4-ボラトリシクロ[7.3.0.03,7]ドデカ-1(12),4,6,8,10-ペンタエン-1-イリウム
  • 8-(3,4-dinitrophenyl)-2,2-difluoro-4,6,10,12-tetramethyl-1λ5,3-diaza-2λ4-boratricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-1-ylium
Other name (3)：
  • 4,4-Difluoro-8-(3,4-dinitrophenyl)-1,3,5,7-tetramethyl-3a-azonia-4a-aza-4-bora(IV)-s-indacene
  • 4,4-Difluoro-1,3,5,7-tetramethyl-8-(3,4-dinitrophenyl)-4H-3a-aza-4a-azonia-4-bora(IV)-s-indacene
  • 8-(3,4-Dinitrophenyl)-4,4-difluoro-1,3,5,7-tetramethyl-3a-aza-4a-azonia-4-bora(IV)-s-indacene
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