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methyl (2Z)-2-anilino-3-(4-methoxybenzoyl)-5-(4-morpholinyl)-4,5-dioxo-2-pentenoate

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methyl (2Z)-2-anilino-3-(4-methoxybenzoyl)-5-(4-morpholinyl)-4,5-dioxo-2-pentenoate
SpectraBase Compound ID Lc94oskJVgI
InChI InChI=1S/C24H24N2O7/c1-31-18-10-8-16(9-11-18)21(27)19(22(28)23(29)26-12-14-33-15-13-26)20(24(30)32-2)25-17-6-4-3-5-7-17/h3-11,25H,12-15H2,1-2H3/b20-19-
InChIKey BFKVQDOPBATFKZ-VXPUYCOJSA-N
Mol Weight 452.46 g/mol
Molecular Formula C24H24N2O7
Exact Mass 452.158351 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JhaIYJLLcK7
Name Methyl (2Z)-2-anilino-3-(4-methoxybenzoyl)-5-(4-morpholinyl)-4,5-dioxo-2-pentenoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 452.158351114 u
Formula C24H24N2O7
InChI InChI=1S/C24H24N2O7/c1-31-18-10-8-16(9-11-18)21(27)19(22(28)23(29)26-12-14-33-15-13-26)20(24(30)32-2)25-17-6-4-3-5-7-17/h3-11,25H,12-15H2,1-2H3/b20-19-
InChIKey BFKVQDOPBATFKZ-VXPUYCOJSA-N
Molecular Weight 452.463 g/mol
SMILES C(\C(=C\(C(C(N1CCOCC1)=O)=O)C(C=1C=CC(=CC1)OC)=O)NC1=CC=CC=C1)(=O)OC