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3-chloro-N'-[2,5-dioxo-1-(4-phenoxyphenyl)-3-pyrrolidinyl]benzohydrazide
SpectraBase Compound ID 8ePgwSIbgaQ
InChI InChI=1S/C23H18ClN3O4/c24-16-6-4-5-15(13-16)22(29)26-25-20-14-21(28)27(23(20)30)17-9-11-19(12-10-17)31-18-7-2-1-3-8-18/h1-13,20,25H,14H2,(H,26,29)
InChIKey UDHJYJQVMUIEKN-UHFFFAOYSA-N
Mol Weight 435.87 g/mol
Molecular Formula C23H18ClN3O4
Exact Mass 435.098584 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6BmIfL1aGN0
Name 3-Chloro-N'-[2,5-dioxo-1-(4-phenoxyphenyl)-3-pyrrolidinyl]benzohydrazide
Comments Computed using HOSE algorithm
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Exact Mass 435.098583768 u
Formula C23H18ClN3O4
InChI InChI=1S/C23H18ClN3O4/c24-16-6-4-5-15(13-16)22(29)26-25-20-14-21(28)27(23(20)30)17-9-11-19(12-10-17)31-18-7-2-1-3-8-18/h1-13,20,25H,14H2,(H,26,29)
InChIKey UDHJYJQVMUIEKN-UHFFFAOYSA-N
Molecular Weight 435.867 g/mol
SMILES N(C1C(N(C(C1)=O)C1=CC=C(OC=2C=CC=CC2)C=C1)=O)NC(C1=CC(Cl)=CC=C1)=O