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N-(3,5-Dimethoxyphenyl)-1-((2,5-dimethoxyphenyl)sulfonyl)piperidine-3-carboxamide

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N-(3,5-Dimethoxyphenyl)-1-((2,5-dimethoxyphenyl)sulfonyl)piperidine-3-carboxamide
SpectraBase Compound ID A9UWJbxViCJ
InChI InChI=1S/C22H28N2O7S/c1-28-17-7-8-20(31-4)21(13-17)32(26,27)24-9-5-6-15(14-24)22(25)23-16-10-18(29-2)12-19(11-16)30-3/h7-8,10-13,15H,5-6,9,14H2,1-4H3,(H,23,25)
InChIKey QEHVGWZCRVAELN-UHFFFAOYSA-N
Mol Weight 464.53 g/mol
Molecular Formula C22H28N2O7S
Exact Mass 464.161722 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6g3i3STnG5e
Name N-(3,5-Dimethoxyphenyl)-1-((2,5-dimethoxyphenyl)sulfonyl)piperidine-3-carboxamide
Comments Computed using HOSE algorithm
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Exact Mass 464.161722417 u
Formula C22H28N2O7S
InChI InChI=1S/C22H28N2O7S/c1-28-17-7-8-20(31-4)21(13-17)32(26,27)24-9-5-6-15(14-24)22(25)23-16-10-18(29-2)12-19(11-16)30-3/h7-8,10-13,15H,5-6,9,14H2,1-4H3,(H,23,25)
InChIKey QEHVGWZCRVAELN-UHFFFAOYSA-N
Molecular Weight 464.533 g/mol
SMILES C1N(CCCC1C(=O)NC1=CC(=CC(=C1)OC)OC)S(=O)(=O)C1=C(C=CC(=C1)OC)OC