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1-(4-chlorophenyl)-6,7-diethoxy-2-phenyl-1,4-dihydro-3(2H)-isoquinolinone

View entire compound with spectra: 2 NMR

1-(4-chlorophenyl)-6,7-diethoxy-2-phenyl-1,4-dihydro-3(2H)-isoquinolinone
SpectraBase Compound ID GxoqPYPtkPU
InChI InChI=1S/C25H24ClNO3/c1-3-29-22-14-18-15-24(28)27(20-8-6-5-7-9-20)25(17-10-12-19(26)13-11-17)21(18)16-23(22)30-4-2/h5-14,16,25H,3-4,15H2,1-2H3
InChIKey ZVLQPSVLHGPCNM-UHFFFAOYSA-N
Mol Weight 421.92 g/mol
Molecular Formula C25H24ClNO3
Exact Mass 421.144471 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ENy3yeE6abz
Name 1-(4-Chlorophenyl)-6,7-diethoxy-2-phenyl-1,4-dihydro-3(2H)-isoquinolinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 421.144471334 u
Formula C25H24ClNO3
InChI InChI=1S/C25H24ClNO3/c1-3-29-22-14-18-15-24(28)27(20-8-6-5-7-9-20)25(17-10-12-19(26)13-11-17)21(18)16-23(22)30-4-2/h5-14,16,25H,3-4,15H2,1-2H3
InChIKey ZVLQPSVLHGPCNM-UHFFFAOYSA-N
Molecular Weight 421.924 g/mol
SMILES C=1C=CC(N2C(CC=3C(C2C2=CC=C(C=C2)Cl)=CC(=C(OCC)C3)OCC)=O)=CC1