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Butanoic acid, 4-oxo-4-[(4-phenoxyphenyl)amino]-, 2-(4-chlorophenyl)-2-oxoethyl ester
SpectraBase Compound ID 4DmTcj5FAnR
InChI InChI=1S/C24H20ClNO5/c25-18-8-6-17(7-9-18)22(27)16-30-24(29)15-14-23(28)26-19-10-12-21(13-11-19)31-20-4-2-1-3-5-20/h1-13H,14-16H2,(H,26,28)
InChIKey QGOAKEUNMGEGER-UHFFFAOYSA-N
Mol Weight 437.88 g/mol
Molecular Formula C24H20ClNO5
Exact Mass 437.103 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 24ykMgf5d9h
Name Butanoic acid, 4-oxo-4-[(4-phenoxyphenyl)amino]-, 2-(4-chlorophenyl)-2-oxoethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 437.103000443 u
Formula C24H20ClNO5
InChI InChI=1S/C24H20ClNO5/c25-18-8-6-17(7-9-18)22(27)16-30-24(29)15-14-23(28)26-19-10-12-21(13-11-19)31-20-4-2-1-3-5-20/h1-13H,14-16H2,(H,26,28)
InChIKey QGOAKEUNMGEGER-UHFFFAOYSA-N
Molecular Weight 437.879 g/mol
SMILES N(C(=O)CCC(OCC(C=1C=CC(=CC1)Cl)=O)=O)C1=CC=C(OC2=CC=CC=C2)C=C1