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Ethyl 3-((E)-1-(2-((Z)-2-cyano-3-(4-chlorophenyl)-2-cyanoacryloyl)hydrazono)ethyl)-1,5-diphenyl-1H-pyrazole-4-carboxylate

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Ethyl 3-((E)-1-(2-((Z)-2-cyano-3-(4-chlorophenyl)-2-cyanoacryloyl)hydrazono)ethyl)-1,5-diphenyl-1H-pyrazole-4-carboxylate
SpectraBase Compound ID 8fozan0zwrN
InChI InChI=1S/C30H24ClN5O3/c1-3-39-30(38)26-27(20(2)33-34-29(37)23(19-32)18-21-14-16-24(31)17-15-21)35-36(25-12-8-5-9-13-25)28(26)22-10-6-4-7-11-22/h4-18H,3H2,1-2H3,(H,34,37)/b23-18-,33-20+
InChIKey BFTKTBFGOYXTSL-VZVVTISASA-N
Mol Weight 538.01 g/mol
Molecular Formula C30H24ClN5O3
Exact Mass 537.156767 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9DknXAbzeyW
Name Ethyl 3-((E)-1-(2-((Z)-2-cyano-3-(4-chlorophenyl)-2-cyanoacryloyl)hydrazono)ethyl)-1,5-diphenyl-1H-pyrazole-4-carboxylate
Alternate Name(s) Ethyl 3-((E)-1-(2-((Z)-3-(4-chlorophenyl)-2-cyanoacryloyl)hydrazineylidene)ethyl)-1,5-diphenyl-1H-pyrazole-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H24ClN5O3
InChI InChI=1S/C30H24ClN5O3/c1-3-39-30(38)26-27(20(2)33-34-29(37)23(19-32)18-21-14-16-24(31)17-15-21)35-36(25-12-8-5-9-13-25)28(26)22-10-6-4-7-11-22/h4-18H,3H2,1-2H3,(H,34,37)/b23-18-,33-20+
InChIKey BFTKTBFGOYXTSL-VZVVTISASA-N
Literature Reference DOI 10.3987/COM-15-13370
Molecular Weight 538.007 g/mol
SMILES N(\N=C\(c1n[n](c(c1C(=O)OCC)-c1ccccc1)-c1ccccc1)C)C(\C(=C/c1ccc(cc1)Cl)C#N)=O
SPLASH splash10-0f79-3311090000-6270418b9593c6244fe4
Source of Spectrum H1-92-657-6e
Wiley ID 1804123