Chem
J-GLOBAL ID:201307077492182376
Nikkaji number:J3.213.044E
1-[5-[3,4,5-Tris(hexadecyloxy)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-[3,4,5-トリス(ヘキサデシルオキシ)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
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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:
C83 H115 BF2 N2 O5
Molecular formula furigana:
C83-H115-B-F2-N2-O5
Molecular weight:
1269.650
InChI:
InChI=1S/C83H115BF2N2O5/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-56-90-74-59-66(60-75(91-57-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)83(74)92-58-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)70-54-55-71(88-70)72(89)61-73(93-84(85)86)82-79-68-53-51-65-49-47-63-46-48-64-50-52-67(69(79)62-87-82)80-77(64)76(63)78(65)81(68)80/h46-55,59-62,87-88H,4-45,56-58H2,1-3H3
InChI key:
NUVMTSGEBOEPKJ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCOc1cc(cc(OCCCCCCCCCCCCCCCC)c1OCCCCCCCCCCCCCCCC)c1ccc([nH]1)C(=O)C=C(OB(F)F)c1[nH]cc2c1c1ccc3ccc4ccc5ccc2c2c5c4c3c12
Systematic name (4):
1-[5-[3,4,5-トリス(ヘキサデシルオキシ)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-[3,4,5-トリス(ヘキサデシルオキシ)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-[3,4,5-トリス(ヘキサデシルオキシ)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-[3,4,5-tris(hexadecyloxy)phenyl]-1H-pyrrol-2-yl}prop-1-en-1-yl difluoroborinate
Other name (2):
1-[5-[3,4,5-Tris(hexadecyloxy)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-[3,4,5-Tris(hexadecyloxy)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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