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ethyl 4-{5-[(1E)-3-anilino-2-cyano-3-oxo-1-propenyl]-2-furyl}benzoate

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ethyl 4-{5-[(1E)-3-anilino-2-cyano-3-oxo-1-propenyl]-2-furyl}benzoate
SpectraBase Compound ID 7xfNuMAk4Mw
InChI InChI=1S/C23H18N2O4/c1-2-28-23(27)17-10-8-16(9-11-17)21-13-12-20(29-21)14-18(15-24)22(26)25-19-6-4-3-5-7-19/h3-14H,2H2,1H3,(H,25,26)/b18-14+
InChIKey FTIVUKGSIBBTAL-NBVRZTHBSA-N
Mol Weight 386.41 g/mol
Molecular Formula C23H18N2O4
Exact Mass 386.126657 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9e1U0JtL1bB
Name Ethyl 4-{5-[(1E)-3-anilino-2-cyano-3-oxo-1-propenyl]-2-furyl}benzoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.126657064 u
Formula C23H18N2O4
InChI InChI=1S/C23H18N2O4/c1-2-28-23(27)17-10-8-16(9-11-17)21-13-12-20(29-21)14-18(15-24)22(26)25-19-6-4-3-5-7-19/h3-14H,2H2,1H3,(H,25,26)/b18-14+
InChIKey FTIVUKGSIBBTAL-NBVRZTHBSA-N
Molecular Weight 386.407 g/mol
SMILES N(C(\C(C#N)=C\C=1OC(=CC1)C1=CC=C(C(=O)OCC)C=C1)=O)C1=CC=CC=C1