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N-[5-chloro-2-(4-propionyl-1-piperazinyl)phenyl]benzamide

View entire compound with spectra: 2 NMR

N-[5-chloro-2-(4-propionyl-1-piperazinyl)phenyl]benzamide
SpectraBase Compound ID EIR3nOxGKYI
InChI InChI=1S/C20H22ClN3O2/c1-2-19(25)24-12-10-23(11-13-24)18-9-8-16(21)14-17(18)22-20(26)15-6-4-3-5-7-15/h3-9,14H,2,10-13H2,1H3,(H,22,26)
InChIKey ZAYXVYJFTMMONO-UHFFFAOYSA-N
Mol Weight 371.87 g/mol
Molecular Formula C20H22ClN3O2
Exact Mass 371.140055 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1E7qty826J7
Name N-[5-Chloro-2-(4-propionyl-1-piperazinyl)phenyl]benzamide
Comments Computed using HOSE algorithm
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Exact Mass 371.140054658 u
Formula C20H22ClN3O2
InChI InChI=1S/C20H22ClN3O2/c1-2-19(25)24-12-10-23(11-13-24)18-9-8-16(21)14-17(18)22-20(26)15-6-4-3-5-7-15/h3-9,14H,2,10-13H2,1H3,(H,22,26)
InChIKey ZAYXVYJFTMMONO-UHFFFAOYSA-N
Molecular Weight 371.868 g/mol
SMILES N(C1=C(N2CCN(CC2)C(=O)CC)C=CC(=C1)Cl)C(=O)C1=CC=CC=C1