Chem
J-GLOBAL ID:201807013628009257
Nikkaji number:J3.722.064G
1,2-Bis[4-[1-(6-phenoxyhexyl)-1H-1,2,3-triazole-4-yl]phenyl]-1,2-diphenylethene
1,2-ビス[4-[1-(6-フェノキシヘキシル)-1H-1,2,3-トリアゾール-4-イル]フェニル]-1,2-ジフェニルエテン
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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:
C54 H54 N6 O2
Molecular formula furigana:
C54-H54-N6-O2
Molecular weight:
819.066
InChI:
InChI=1S/C54H54N6O2/c1(3-19-39-61-49-25-13-7-14-26-49)17-37-59-41-51(55-57-59)43-29-33-47(34-30-43)53(45-21-9-5-10-22-45)54(46-23-11-6-12-24-46)48-35-31-44(32-36-48)52-42-60(58-56-52)38-18-2-4-20-40-62-50-27-15-8-16-28-50/h5-16,21-36,41-42H,1-4,17-20,37-40H2
InChI key:
PHDKQINHPZMEOY-UHFFFAOYSA-N
SMILES:
C(CCCn1cc(nn1)c1ccc(cc1)C(=C(c1ccccc1)c1ccc(cc1)c1cn(CCCCCCOc2ccccc2)nn1)c1ccccc1)CCOc1ccccc1
Systematic name (3):
1,2-ビス[4-[1-(6-フェノキシヘキシル)-1H-1,2,3-トリアゾール-4-イル]フェニル]-1,2-ジフェニルエテン
1-(6-フェノキシヘキシル)-4-[4-(2-{4-[1-(6-フェノキシヘキシル)-1H-1,2,3-トリアゾール-4-イル]フェニル}-1,2-ジフェニルエテニル)フェニル]-1H-1,2,3-トリアゾール
1-(6-phenoxyhexyl)-4-[4-(2-{4-[1-(6-phenoxyhexyl)-1H-1,2,3-triazol-4-yl]phenyl}-1,2-diphenylethenyl)phenyl]-1H-1,2,3-triazole
Other name (1):
1,2-Bis[4-[1-(6-phenoxyhexyl)-1H-1,2,3-triazole-4-yl]phenyl]-1,2-diphenylethene
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