Chem
J-GLOBAL ID：201307088088921558   Nikkaji number：J3.213.043G

1-(5-Phenyl-1H-pyrrole-2-yl)-3-[(difluoroboryl)oxy]-3-[3,4-(benzo[ghi]fluoranthene-5,6-diyl)-1H-pyrrole-2-yl]-2-propene-1-one

1-(5-フェニル-1H-ピロール-2-イル)-3-[(ジフルオロボリル)オキシ]-3-[3,4-(ベンゾ[ghi]フルオランテン-5,6-ジイル)-1H-ピロール-2-イル]-2-プロペン-1-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： C35H19BF2N2O2
Molecular formula furigana： C35-H19-B-F2-N2-O2
Molecular weight： 548.360
InChI： InChI=1S/C35H19BF2N2O2/c37-36(38)42-28(16-27(41)26-15-14-25(40-26)18-4-2-1-3-5-18)35-32-23-13-11-21-9-7-19-6-8-20-10-12-22(24(32)17-39-35)33-30(20)29(19)31(21)34(23)33/h1-17,39-40H
InChI key： YBQPQWWYHVGDJG-UHFFFAOYSA-N
SMILES： FB(F)OC(=CC(=O)c1ccc([nH]1)c1ccccc1)c1[nH]cc2c1c1ccc3ccc4ccc5ccc2c2c5c4c3c12
Systematic name  (4)：
  • 1-(5-フェニル-1H-ピロール-2-イル)-3-(ジフルオロボリルオキシ)-3-[1,3-(1,2-ジヒドロジベンゾ[ghi,mno]フルオランテン-1,2-ジイリデン)-2-アザプロパン-1-イル]-2-プロペン-1-オン
  • 1-(5-フェニル-1H-ピロール-2-イル)-3-[(ジフルオロボリル)オキシ]-3-[3,4-(ベンゾ[ghi]フルオランテン-5,6-ジイル)-1H-ピロール-2-イル]-2-プロペン-1-オン
  • 1-{4-アザヘプタシクロ[14.5.2.02,6.07,20.010,19.013,18.017,21]トリコサ-1(22),2,5,7(20),8,10,12,14,16(23),17(21),18-ウンデカエン-3-イル}-3-オキソ-3-(5-フェニル-1H-ピロール-2-イル)プロパ-1-エン-1-イル ジフルオロボリナート
  • 1-{4-azaheptacyclo[14.5.2.02,6.07,20.010,19.013,18.017,21]tricosa-1(22),2,5,7(20),8,10,12,14,16(23),17(21),18-undecaen-3-yl}-3-oxo-3-(5-phenyl-1H-pyrrol-2-yl)prop-1-en-1-yl difluoroborinate
Other name (2)：
  • 1-(5-Phenyl-1H-pyrrole-2-yl)-3-(difluoroboryloxy)-3-[1,3-(1,2-dihydrodibenzo[ghi,mno]fluoranthene-1,2-diylidene)-2-azapropane-1-yl]-2-propene-1-one
  • 1-(5-Phenyl-1H-pyrrole-2-yl)-3-[(difluoroboryl)oxy]-3-[3,4-(benzo[ghi]fluoranthene-5,6-diyl)-1H-pyrrole-2-yl]-2-propene-1-one
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