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3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-methoxyphenyl)-2,5-pyrrolidinedione

View entire compound with spectra: 2 NMR

3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-methoxyphenyl)-2,5-pyrrolidinedione
SpectraBase Compound ID 2nnHDIiFEZD
InChI InChI=1S/C20H20N2O3/c1-25-17-8-6-16(7-9-17)22-19(23)12-18(20(22)24)21-11-10-14-4-2-3-5-15(14)13-21/h2-9,18H,10-13H2,1H3
InChIKey OFTLCEWTVFPNAJ-UHFFFAOYSA-N
Mol Weight 336.39 g/mol
Molecular Formula C20H20N2O3
Exact Mass 336.147393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LIvoMjOieLC
Name 3-(3,4-Dihydro-2(1H)-isoquinolinyl)-1-(4-methoxyphenyl)-2,5-pyrrolidinedione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 336.147392509 u
Formula C20H20N2O3
InChI InChI=1S/C20H20N2O3/c1-25-17-8-6-16(7-9-17)22-19(23)12-18(20(22)24)21-11-10-14-4-2-3-5-15(14)13-21/h2-9,18H,10-13H2,1H3
InChIKey OFTLCEWTVFPNAJ-UHFFFAOYSA-N
Molecular Weight 336.391 g/mol
SMILES C=1C=C2CCN(C3C(N(C(C3)=O)C3=CC=C(C=C3)OC)=O)CC2=CC1