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3-(4-chlorophenyl)-2-[(Z)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-4(3H)-quinazolinone
SpectraBase Compound ID L7xniu89KRm
InChI InChI=1S/C23H14ClN3O2/c24-14-9-11-15(12-10-14)27-21(25-20-8-4-2-6-17(20)23(27)29)13-18-16-5-1-3-7-19(16)26-22(18)28/h1-13H,(H,26,28)/b18-13-
InChIKey WXOJHLYALXYYFQ-AQTBWJFISA-N
Mol Weight 399.84 g/mol
Molecular Formula C23H14ClN3O2
Exact Mass 399.077454 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hc2qEifJQ5r
Name 3-(4-Chlorophenyl)-2-[(Z)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-4(3H)-quinazolinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 399.077454401 u
Formula C23H14ClN3O2
InChI InChI=1S/C23H14ClN3O2/c24-14-9-11-15(12-10-14)27-21(25-20-8-4-2-6-17(20)23(27)29)13-18-16-5-1-3-7-19(16)26-22(18)28/h1-13H,(H,26,28)/b18-13-
InChIKey WXOJHLYALXYYFQ-AQTBWJFISA-N
Molecular Weight 399.837 g/mol
SMILES N1C2=C(\C(C1=O)=C/C=1N(C(C=3C(=CC=CC3)N1)=O)C=1C=CC(=CC1)Cl)C=CC=C2