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(E)-2-((E)-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl) diazenyl)-3-((Z)-2-oxoindolin-3-ylideneamino)-3-(piperidin-1-yl)acrylonitrile
SpectraBase Compound ID 3E3nFVcQO9L
InChI InChI=1S/C27H26N8O2/c1-18-23(27(37)35(33(18)2)19-11-5-3-6-12-19)32-31-22(17-28)25(34-15-9-4-10-16-34)30-24-20-13-7-8-14-21(20)29-26(24)36/h3,5-8,11-14H,4,9-10,15-16H2,1-2H3,(H,29,30,36)/b25-22-,32-31+
InChIKey DISSXJFWUDBDBG-WHCPJMTISA-N
Mol Weight 494.56 g/mol
Molecular Formula C27H26N8O2
Exact Mass 494.217872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GspKTGrcZx9
Name (E)-2-((E)-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl) diazenyl)-3-((Z)-2-oxoindolin-3-ylideneamino)-3-(piperidin-1-yl)acrylonitrile
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Formula C27H26N8O2
InChI InChI=1S/C27H26N8O2/c1-18-23(27(37)35(33(18)2)19-11-5-3-6-12-19)32-31-22(17-28)25(34-15-9-4-10-16-34)30-24-20-13-7-8-14-21(20)29-26(24)36/h3,5-8,11-14H,4,9-10,15-16H2,1-2H3,(H,29,30,36)/b25-22-,32-31+
InChIKey DISSXJFWUDBDBG-WHCPJMTISA-N
Molecular Weight 494.559 g/mol
SMILES N1c2c(\C(C1=O)=N/C(=C\(\N=N\C=1C(N(c3ccccc3)N(C1C)C)=O)C#N)N1CCCCC1)cccc2
SPLASH splash10-00or-9871100000-0e2bb21ce4ed2b73e779
Source of Spectrum Y-51-1702-11
Synonyms (E)-2-((E)-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)diazenyl)-3-((Z)-2-oxoindolin-3-ylideneamino)-3-(piperidin-1-yl)acrylonitrile (E)-2-((E)-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)diazenyl)-3-((Z)-(2-oxoindolin-3-ylidene)amino)-3-(piperidin-1-yl)acrylonitrile
Wiley ID 1741640