Chem
J-GLOBAL ID：200907000678763357   Nikkaji number：J2.580.653K

N,N′-(5-Bromo-3-heptyne-1,7-diyl)bis(4-nitrobenzenesulfonamide)

N,N′-(5-ブロモ-3-ヘプチン-1,7-ジイル)ビス(4-ニトロベンゼンスルホンアミド)
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： C19H19BrN2[N+]2O6[O-]2S2
Molecular formula furigana： C19-H19-BR-N4-O8-S2
Molecular weight： 575.410
InChI： InChI=1S/C19H19BrN4O8S2/c20-15(12-14-22-34(31,32)19-10-6-17(7-11-19)24(27)28)3-1-2-13-21-33(29,30)18-8-4-16(5-9-18)23(25)26/h4-11,15,21-22H,2,12-14H2
InChI key： VUUDNZSDFRWWFI-UHFFFAOYSA-N
SMILES： [O-][N+](=O)c1ccc(cc1)S(=O)(=O)NCCC#CC(Br)CCNS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
Systematic name  (3)：
  • N,N′-(5-ブロモ-3-ヘプチン-1,7-ジイル)ビス(4-ニトロベンゼンスルホンアミド)
  • N-[5-ブロモ-7-(4-ニトロベンゼンスルホンアミド)ヘプタ-3-イン-1-イル]-4-ニトロベンゼン-1-スルホンアミド
  • N-[5-bromo-7-(4-nitrobenzenesulfonamido)hept-3-yn-1-yl]-4-nitrobenzene-1-sulfonamide
Other name (1)：
  • N,N′-(5-Bromo-3-heptyne-1,7-diyl)bis(4-nitrobenzenesulfonamide)
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