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2-methoxy-4-{(E)-[(3-toluidinoacetyl)hydrazono]methyl}phenyl 3-methoxybenzoate
SpectraBase Compound ID 8wWGDhnhT7x
InChI InChI=1S/C25H25N3O5/c1-17-6-4-8-20(12-17)26-16-24(29)28-27-15-18-10-11-22(23(13-18)32-3)33-25(30)19-7-5-9-21(14-19)31-2/h4-15,26H,16H2,1-3H3,(H,28,29)/b27-15+
InChIKey STRXSJVVTFJDDN-JFLMPSFJSA-N
Mol Weight 447.49 g/mol
Molecular Formula C25H25N3O5
Exact Mass 447.179421 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6bJWSVePSc0
Name 2-Methoxy-4-{(E)-[(3-toluidinoacetyl)hydrazono]methyl}phenyl 3-methoxybenzoate
Comments Computed using HOSE algorithm
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Exact Mass 447.179420912 u
Formula C25H25N3O5
InChI InChI=1S/C25H25N3O5/c1-17-6-4-8-20(12-17)26-16-24(29)28-27-15-18-10-11-22(23(13-18)32-3)33-25(30)19-7-5-9-21(14-19)31-2/h4-15,26H,16H2,1-3H3,(H,28,29)/b27-15+
InChIKey STRXSJVVTFJDDN-JFLMPSFJSA-N
Molecular Weight 447.491 g/mol
SMILES N(C(CNC1=CC(C)=CC=C1)=O)\N=C\C1=CC=C(OC(C=2C=C(OC)C=CC2)=O)C(=C1)OC