Chem
J-GLOBAL ID：201207012043490269   Nikkaji number：J3.061.097K

4-Bromo-2,6-[(cyclohexane-1α,2β-diyl)bis[nitrilomethylidyne(2-hydroxy-5-bromo-m-phenylene)methylidynenitrilo(cyclohexane-1α,2β-diyl)nitrilomethylidyne]]phenol

4-ブロモ-2,6-[(シクロヘキサン-1α,2β-ジイル)ビス[ニトリロメチリジン(2-ヒドロキシ-5-ブロモ-m-フェニレン)メチリジンニトリロ(シクロヘキサン-1α,2β-ジイル)ニトリロメチリジン]]フェノール
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： C42H45Br3N6O3
Molecular formula furigana： C42-H45-BR3-N6-O3
Molecular weight： 921.573
InChI： InChI=1S/C42H45Br3N6O3/c43-31-13-25-19-46-34-7-1-2-8-35(34)47-20-26-14-32(44)16-28(41(26)53)22-49-38-11-5-6-12-39(38)51-24-30-18-33(45)17-29(42(30)54)23-50-37-10-4-3-9-36(37)48-21-27(15-31)40(25)52/h13-24,34-39,52-54H,1-12H2/t34-,35-,36-,37-,38-,39-/m0/s1
InChI key： SMTYIPDVGRCHBX-BGBFCPIGSA-N
SMILES： Oc1c2cc(Br)cc1C=N[C@H]1CCCC[C@@H]1N=Cc1cc(Br)cc(C=N[C@H]3CCCC[C@@H]3N=Cc3cc(Br)cc(C=N[C@H]4CCCC[C@@H]4N=C2)c3O)c1O
Systematic name  (3)：
  • 4-ブロモ-2,6-[(シクロヘキサン-1α,2β-ジイル)ビス[ニトリロメチリジン(2-ヒドロキシ-5-ブロモ-m-フェニレン)メチリジンニトリロ(シクロヘキサン-1α,2β-ジイル)ニトリロメチリジン]]フェノール
  • (4S,9S,19S,24S,34S,39S)-14,29,44-トリブロモ-3,10,18,25,33,40-ヘキサアザヘプタシクロ[40.3.1.112,16.127,31.04,9.019,24.034,39]オクタテトラコンタ-1(46),2,10,12,14,16(48),17,25,27(47),28,30,32,40,42,44-ペンタデカエン-46,47,48-トリオール
  • (4S,9S,19S,24S,34S,39S)-14,29,44-tribromo-3,10,18,25,33,40-hexaazaheptacyclo[40.3.1.112,16.127,31.04,9.019,24.034,39]octatetraconta-1(46),2,10,12,14,16(48),17,25,27(47),28,30,32,40,42,44-pentadecaene-46,47,48-triol
Other name (1)：
  • 4-Bromo-2,6-[(cyclohexane-1α,2β-diyl)bis[nitrilomethylidyne(2-hydroxy-5-bromo-m-phenylene)methylidynenitrilo(cyclohexane-1α,2β-diyl)nitrilomethylidyne]]phenol
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM