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2,4(1H,3H)-quinazolinedione, 3-(3-chlorophenyl)-1-[(2-chlorophenyl)methyl]-6,7-dimethoxy-
SpectraBase Compound ID DMo6itae7sr
InChI InChI=1S/C23H18Cl2N2O4/c1-30-20-11-17-19(12-21(20)31-2)26(13-14-6-3-4-9-18(14)25)23(29)27(22(17)28)16-8-5-7-15(24)10-16/h3-12H,13H2,1-2H3
InChIKey UPIFZELAYWDRHG-UHFFFAOYSA-N
Mol Weight 457.31 g/mol
Molecular Formula C23H18Cl2N2O4
Exact Mass 456.064362 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FIIxaffGrCt
Name 2,4(1H,3H)-Quinazolinedione, 3-(3-chlorophenyl)-1-[(2-chlorophenyl)methyl]-6,7-dimethoxy-
Comments Computed using HOSE algorithm
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Exact Mass 456.064362464 u
Formula C23H18Cl2N2O4
InChI InChI=1S/C23H18Cl2N2O4/c1-30-20-11-17-19(12-21(20)31-2)26(13-14-6-3-4-9-18(14)25)23(29)27(22(17)28)16-8-5-7-15(24)10-16/h3-12H,13H2,1-2H3
InChIKey UPIFZELAYWDRHG-UHFFFAOYSA-N
Molecular Weight 457.313 g/mol
SMILES C1=CC=C(CN2C(N(C(C=3C2=CC(=C(C3)OC)OC)=O)C2=CC(Cl)=CC=C2)=O)C(Cl)=C1