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Benzenepropanoic acid, 4-methoxy-beta-[[[3-(4-methoxyphenyl)-5-isoxazolyl]carbonyl]amino]-, ethyl ester
SpectraBase Compound ID 34l9C6iQ77o
InChI InChI=1S/C23H24N2O6/c1-4-30-22(26)14-19(15-5-9-17(28-2)10-6-15)24-23(27)21-13-20(25-31-21)16-7-11-18(29-3)12-8-16/h5-13,19H,4,14H2,1-3H3,(H,24,27)
InChIKey VDAMWNJCIGVQPJ-UHFFFAOYSA-N
Mol Weight 424.45 g/mol
Molecular Formula C23H24N2O6
Exact Mass 424.163436 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BmjTkLW0E9Q
Name Benzenepropanoic acid, 4-methoxy-beta-[[[3-(4-methoxyphenyl)-5-isoxazolyl]carbonyl]amino]-, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 424.163436495 u
Formula C23H24N2O6
InChI InChI=1S/C23H24N2O6/c1-4-30-22(26)14-19(15-5-9-17(28-2)10-6-15)24-23(27)21-13-20(25-31-21)16-7-11-18(29-3)12-8-16/h5-13,19H,4,14H2,1-3H3,(H,24,27)
InChIKey VDAMWNJCIGVQPJ-UHFFFAOYSA-N
Molecular Weight 424.453 g/mol
SMILES N(C(C=1ON=C(C1)C=1C=CC(OC)=CC1)=O)C(CC(OCC)=O)C1=CC=C(C=C1)OC