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5-chloro-N-{4-[(5-chloro-2-methoxybenzoyl)amino]butyl}-2-methoxybenzamide
SpectraBase Compound ID 6d6WqMrzF90
InChI InChI=1S/C20H22Cl2N2O4/c1-27-17-7-5-13(21)11-15(17)19(25)23-9-3-4-10-24-20(26)16-12-14(22)6-8-18(16)28-2/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,23,25)(H,24,26)
InChIKey YDYHPCKUEJYTHX-UHFFFAOYSA-N
Mol Weight 425.31 g/mol
Molecular Formula C20H22Cl2N2O4
Exact Mass 424.095663 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LiK52E7CsCT
Name 5-Chloro-N-{4-[(5-chloro-2-methoxybenzoyl)amino]butyl}-2-methoxybenzamide
Comments Computed using HOSE algorithm
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Exact Mass 424.095662592 u
Formula C20H22Cl2N2O4
InChI InChI=1S/C20H22Cl2N2O4/c1-27-17-7-5-13(21)11-15(17)19(25)23-9-3-4-10-24-20(26)16-12-14(22)6-8-18(16)28-2/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,23,25)(H,24,26)
InChIKey YDYHPCKUEJYTHX-UHFFFAOYSA-N
Molecular Weight 425.312 g/mol
SMILES N(C(C=1C(=CC=C(C1)Cl)OC)=O)CCCCNC(C=1C(=CC=C(C1)Cl)OC)=O