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1-[2-Hydroxyethyl]-4-[4-[7-chloro-4-quinolylamino]benzoyl]piperazine
SpectraBase Compound ID Af162xqnmA6
InChI InChI=1S/C22H23ClN4O2/c23-17-3-6-19-20(7-8-24-21(19)15-17)25-18-4-1-16(2-5-18)22(29)27-11-9-26(10-12-27)13-14-28/h1-8,15,28H,9-14H2,(H,24,25)
InChIKey TTYCKXHFJZDJEX-UHFFFAOYSA-N
Mol Weight 410.91 g/mol
Molecular Formula C22H23ClN4O2
Exact Mass 410.150954 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8WI1h8MQtRj
Name 1-[2-Hydroxyethyl]-4-[4-[7-chloro-4-quinolylamino]benzoyl]piperazine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.150953695 u
Formula C22H23ClN4O2
InChI InChI=1S/C22H23ClN4O2/c23-17-3-6-19-20(7-8-24-21(19)15-17)25-18-4-1-16(2-5-18)22(29)27-11-9-26(10-12-27)13-14-28/h1-8,15,28H,9-14H2,(H,24,25)
InChIKey TTYCKXHFJZDJEX-UHFFFAOYSA-N
Molecular Weight 410.905 g/mol
SMILES C1=2C(=CC=C(C2)Cl)C(=CC=N1)NC1=CC=C(C=C1)C(N1CCN(CC1)CCO)=O