Chem
J-GLOBAL ID：200907059984054364   Nikkaji number：J1.333.967H

K-7174

K-7174
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： C33H48N2O6
Molecular formula furigana： C33-H48-N2-O6
Molecular weight： 568.755
InChI： InChI=1S/C33H48N2O6/c1-36-28-22-26(23-29(37-2)32(28)40-5)14-9-7-11-16-34-18-13-19-35(21-20-34)17-12-8-10-15-27-24-30(38-3)33(41-6)31(25-27)39-4/h9-10,14-15,22-25H,7-8,11-13,16-21H2,1-6H3/b14-9+,15-10+
InChI key： JXXCDAKRSXICGM-AOEKMSOUSA-N
SMILES： COc1cc(/C=C/CCCN2CCCN(CCC/C=C/c3cc(OC)c(OC)c(OC)c3)CC2)cc(OC)c1OC
Systematic name  (3)：
  • 1,4-ビス[(E)-5-(3,4,5-トリメトキシフェニル)-4-ペンテニル]ヘキサヒドロ-1H-1,4-ジアゼピン
  • 1,4-ビス[(4E)-5-(3,4,5-トリメトキシフェニル)ペンタ-4-エン-1-イル]-1,4-ジアゼパン
  • 1,4-bis[(4E)-5-(3,4,5-trimethoxyphenyl)pent-4-en-1-yl]-1,4-diazepane
Other name (2)：
  • 1,4-Bis[(E)-5-(3,4,5-trimethoxyphenyl)-4-pentenyl]hexahydro-1H-1,4-diazepine
  • K-7174
CAS registry number： 191089-59-5
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