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3-(4-Chloroanilino)-1-(4-propoxyphenyl)-2,5-pyrrolidinedione

View entire compound with spectra: 2 NMR

3-(4-Chloroanilino)-1-(4-propoxyphenyl)-2,5-pyrrolidinedione
SpectraBase Compound ID bK0eyshW7U
InChI InChI=1S/C19H19ClN2O3/c1-2-11-25-16-9-7-15(8-10-16)22-18(23)12-17(19(22)24)21-14-5-3-13(20)4-6-14/h3-10,17,21H,2,11-12H2,1H3
InChIKey LEKUIONKQPFBRC-UHFFFAOYSA-N
Mol Weight 358.83 g/mol
Molecular Formula C19H19ClN2O3
Exact Mass 358.10842 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CvvrmFQvErL
Name 3-(4-Chloroanilino)-1-(4-propoxyphenyl)-2,5-pyrrolidinedione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 358.108420177 u
Formula C19H19ClN2O3
InChI InChI=1S/C19H19ClN2O3/c1-2-11-25-16-9-7-15(8-10-16)22-18(23)12-17(19(22)24)21-14-5-3-13(20)4-6-14/h3-10,17,21H,2,11-12H2,1H3
InChIKey LEKUIONKQPFBRC-UHFFFAOYSA-N
Molecular Weight 358.825 g/mol
SMILES N(C1C(N(C(C1)=O)C=1C=CC(=CC1)OCCC)=O)C=1C=CC(=CC1)Cl