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ethyl 4-({(2E)-3-[5-(4-chlorophenyl)-2-furyl]-2-cyano-2-propenoyl}amino)benzoate
SpectraBase Compound ID EleiYRNLdve
InChI InChI=1S/C23H17ClN2O4/c1-2-29-23(28)16-5-9-19(10-6-16)26-22(27)17(14-25)13-20-11-12-21(30-20)15-3-7-18(24)8-4-15/h3-13H,2H2,1H3,(H,26,27)/b17-13+
InChIKey KXZNPOHPNPVSJJ-GHRIWEEISA-N
Mol Weight 420.85 g/mol
Molecular Formula C23H17ClN2O4
Exact Mass 420.087685 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HnCrgLzL4mO
Name Ethyl 4-({(2E)-3-[5-(4-chlorophenyl)-2-furyl]-2-cyano-2-propenoyl}amino)benzoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 420.087684731 u
Formula C23H17ClN2O4
InChI InChI=1S/C23H17ClN2O4/c1-2-29-23(28)16-5-9-19(10-6-16)26-22(27)17(14-25)13-20-11-12-21(30-20)15-3-7-18(24)8-4-15/h3-13H,2H2,1H3,(H,26,27)/b17-13+
InChIKey KXZNPOHPNPVSJJ-GHRIWEEISA-N
Molecular Weight 420.852 g/mol
SMILES N(C(\C(C#N)=C\C=1OC(=CC1)C1=CC=C(C=C1)Cl)=O)C=1C=CC(C(=O)OCC)=CC1