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benzoic acid, 3-[[(2E)-3-(2-furanyl)-2-[(2-methoxybenzoyl)amino]-1-oxo-2-propenyl]amino]-, methyl ester
SpectraBase Compound ID 3Ga0rY1MQW
InChI InChI=1S/C23H20N2O6/c1-29-20-11-4-3-10-18(20)21(26)25-19(14-17-9-6-12-31-17)22(27)24-16-8-5-7-15(13-16)23(28)30-2/h3-14H,1-2H3,(H,24,27)(H,25,26)/b19-14+
InChIKey DMEJCPVCRRAHFC-XMHGGMMESA-N
Mol Weight 420.42 g/mol
Molecular Formula C23H20N2O6
Exact Mass 420.132136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LkJ5P3VAavw
Name Benzoic acid, 3-[[(2E)-3-(2-furanyl)-2-[(2-methoxybenzoyl)amino]-1-oxo-2-propenyl]amino]-, methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 420.132136366 u
Formula C23H20N2O6
InChI InChI=1S/C23H20N2O6/c1-29-20-11-4-3-10-18(20)21(26)25-19(14-17-9-6-12-31-17)22(27)24-16-8-5-7-15(13-16)23(28)30-2/h3-14H,1-2H3,(H,24,27)(H,25,26)/b19-14+
InChIKey DMEJCPVCRRAHFC-XMHGGMMESA-N
Molecular Weight 420.421 g/mol
SMILES N(C(\C(NC(C1=C(OC)C=CC=C1)=O)=C\C=1OC=CC1)=O)C1=CC(C(=O)OC)=CC=C1