Chem
J-GLOBAL ID:200907051152373477   Nikkaji number:J2.065.527E

2-(Iodoacetylamino)-4,4-difluoro-1,3,5,7-tetramethyl-3a-azonia-4a-aza-4-bora(V)-s-indacene-4-ide

2-(ヨードアセチルアミノ)-4,4-ジフルオロ-1,3,5,7-テトラメチル-3a-アゾニア-4a-アザ-4-ボラ(V)-s-インダセン-4-イド
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: C15H17[B-]F2IN2[N+]O
Molecular formula furigana: C15-H17-B-F2-I-N3-O
Molecular weight: 431.030
InChI: InChI=1S/C15H17BF2IN3O/c1-8-5-9(2)21-12(8)6-13-10(3)15(20-14(23)7-19)11(4)22(13)16(21,17)18/h5-6H,7H2,1-4H3,(H,20,23)
InChI key: VNYJEIXHFTXUQM-UHFFFAOYSA-N
SMILES: CC1=C(NC(=O)CI)C(=[N+]2C1=Cc1c(C)cc(C)n1[B-]2(F)F)C
Systematic name  (3):
  • 2-(ヨードアセチルアミノ)-4,4-ジフルオロ-1,3,5,7-テトラメチル-3a-アゾニア-4a-アザ-4-ボラ(V)-s-インダセン-4-イド
  • 2,2-ジフルオロ-11-(2-ヨードアセトアミド)-4,6,10,12-テトラメチル-1λ5,3-ジアザ-2-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-2-ウイド
  • 2,2-difluoro-11-(2-iodoacetamido)-4,6,10,12-tetramethyl-1λ5,3-diaza-2-boratricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-1-ylium-2-uide
Other name (1):
  • 2-(Iodoacetylamino)-4,4-difluoro-1,3,5,7-tetramethyl-3a-azonia-4a-aza-4-bora(V)-s-indacene-4-ide
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