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1,2-benzisothiazole-2-acetamide, N-(4-ethoxyphenyl)-2,3-dihydro-3-oxo-, 1,1-dioxide
SpectraBase Compound ID K764zdf4woF
InChI InChI=1S/C17H16N2O5S/c1-2-24-13-9-7-12(8-10-13)18-16(20)11-19-17(21)14-5-3-4-6-15(14)25(19,22)23/h3-10H,2,11H2,1H3,(H,18,20)
InChIKey JCWSCYCCFWEXIR-UHFFFAOYSA-N
Mol Weight 360.38 g/mol
Molecular Formula C17H16N2O5S
Exact Mass 360.077993 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ATbrfwh9frx
Name 1,2-Benzisothiazole-2-acetamide, N-(4-ethoxyphenyl)-2,3-dihydro-3-oxo-, 1,1-dioxide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.077992792 u
Formula C17H16N2O5S
InChI InChI=1S/C17H16N2O5S/c1-2-24-13-9-7-12(8-10-13)18-16(20)11-19-17(21)14-5-3-4-6-15(14)25(19,22)23/h3-10H,2,11H2,1H3,(H,18,20)
InChIKey JCWSCYCCFWEXIR-UHFFFAOYSA-N
Molecular Weight 360.384 g/mol
SMILES N(C(CN1S(C=2C(=CC=CC2)C1=O)(=O)=O)=O)C1=CC=C(C=C1)OCC