Chem
J-GLOBAL ID：201207008458265662   Nikkaji number：J3.087.144H

4,4-Difluoro-5-[4-(dipropargylamino)styryl]-8-phenyl-4H-3a-azonia-4-bora(IV)-4a-aza-s-indacene

4,4-ジフルオロ-5-[4-(ジプロパルギルアミノ)スチリル]-8-フェニル-4H-3a-アゾニア-4-ボラ(IV)-4a-アザ-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： C29H22BF2N2[N+]
Molecular formula furigana： C29-H22-B-F2-N3
Molecular weight： 461.320
InChI： InChI=1S/C29H22BF2N3/c1-3-20-33(21-4-2)25-15-12-23(13-16-25)14-17-26-18-19-28-29(24-9-6-5-7-10-24)27-11-8-22-34(27)30(31,32)35(26)28/h1-2,5-19,22H,20-21H2/q+1
InChI key： KUXTWLXWTSXSNR-UHFFFAOYSA-N
SMILES： F[B]1(F)n2c(C=Cc3ccc(cc3)N(CC#C)CC#C)ccc2C(=C2C=CC=[N+]12)c1ccccc1
Systematic name  (3)：
  • 4,4-ジフルオロ-5-[4-(ジプロパルギルアミノ)スチリル]-8-フェニル-4H-3a-アゾニア-4-ボラ(IV)-4a-アザ-s-インダセン
  • 4-(2-{4-[ビス(プロパ-2-イン-1-イル)アミノ]フェニル}エテニル)-2,2-ジフルオロ-8-フェニル-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
  • 4-(2-{4-[bis(prop-2-yn-1-yl)amino]phenyl}ethenyl)-2,2-difluoro-8-phenyl-1λ5,3-diaza-2λ4-boratricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-1-ylium
Other name (1)：
  • 4,4-Difluoro-5-[4-(dipropargylamino)styryl]-8-phenyl-4H-3a-azonia-4-bora(IV)-4a-aza-s-indacene
Thsaurus map：
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