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3-chloro-N-(4-{[(3,4-dimethylphenoxy)acetyl]amino}phenyl)benzamide
SpectraBase Compound ID IPV0zJVHuGU
InChI InChI=1S/C23H21ClN2O3/c1-15-6-11-21(12-16(15)2)29-14-22(27)25-19-7-9-20(10-8-19)26-23(28)17-4-3-5-18(24)13-17/h3-13H,14H2,1-2H3,(H,25,27)(H,26,28)
InChIKey UDBBBQBVULNVCX-UHFFFAOYSA-N
Mol Weight 408.89 g/mol
Molecular Formula C23H21ClN2O3
Exact Mass 408.12407 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DF4MHFZTfWI
Name 3-Chloro-N-(4-{[(3,4-dimethylphenoxy)acetyl]amino}phenyl)benzamide
Comments Computed using HOSE algorithm
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Exact Mass 408.124070241 u
Formula C23H21ClN2O3
InChI InChI=1S/C23H21ClN2O3/c1-15-6-11-21(12-16(15)2)29-14-22(27)25-19-7-9-20(10-8-19)26-23(28)17-4-3-5-18(24)13-17/h3-13H,14H2,1-2H3,(H,25,27)(H,26,28)
InChIKey UDBBBQBVULNVCX-UHFFFAOYSA-N
Molecular Weight 408.885 g/mol
SMILES N(C(C1=CC(Cl)=CC=C1)=O)C1=CC=C(NC(=O)COC2=CC(C)=C(C=C2)C)C=C1