Chem
J-GLOBAL ID：200907068324442395   Nikkaji number：J710.274G

2-[(E)-4′-(Hexyloxy)stilben-4-yl]-4-[4-(dimethylamino)phenyl]-1,3-dioxylato-3-cyclobutene-1,2-diium

2-[(E)-4′-(ヘキシルオキシ)スチルベン-4-イル]-4-[4-(ジメチルアミノ)フェニル]-1,3-ジオキシラト-3-シクロブテン-1,2-ジイウム
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： C30[C+]2H33NO[O-]2
Molecular formula furigana： C32-H33-N-O3
Molecular weight： 479.620
InChI： InChI=1S/C32H34NO3/c1-4-5-6-7-22-36-28-20-12-24(13-21-28)9-8-23-10-14-25(15-11-23)29-31(34)30(32(29)35)26-16-18-27(19-17-26)33(2)3/h8-21H,4-7,22H2,1-3H3,(H-,34,35)/q+1/p-1/b9-8+
InChI key： DBMWSEOGLFLFFA-CMDGGOBGSA-M
SMILES： CCCCCCOc1ccc(/C=C/c2ccc(cc2)[C+]2=[C+]([O-])C(=C2[O-])c2ccc(cc2)N(C)C)cc1
Systematic name  (3)：
  • 2-[(E)-4′-(ヘキシルオキシ)スチルベン-4-イル]-4-[4-(ジメチルアミノ)フェニル]-1,3-ジオキシラト-3-シクロブテン-1,2-ジイウム
  • 3-[4-(ジメチルアミノ)フェニル]-1-{4-[(1E)-2-[4-(ヘキシルオキシ)フェニル]エテニル]フェニル}シクロブタ-1,3-ジエン-2-イウム-1-イリウム-2,4-ビス(オラート)
  • 3-[4-(dimethylamino)phenyl]-1-{4-[(1E)-2-[4-(hexyloxy)phenyl]ethenyl]phenyl}cyclobuta-1,3-dien-2-ium-1-ylium-2,4-bis(olate)
Other name (1)：
  • 2-[(E)-4′-(Hexyloxy)stilben-4-yl]-4-[4-(dimethylamino)phenyl]-1,3-dioxylato-3-cyclobutene-1,2-diium
Thsaurus map：
Thesaurus Map

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