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2-[1-(4-bromobenzoyl)indol-3-yl]-N-(2-chloro-3-pyridyl)acetamide

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2-[1-(4-bromobenzoyl)indol-3-yl]-N-(2-chloro-3-pyridyl)acetamide
SpectraBase Compound ID HgksTSe2khD
InChI InChI=1S/C22H15BrClN3O2/c23-16-9-7-14(8-10-16)22(29)27-13-15(17-4-1-2-6-19(17)27)12-20(28)26-18-5-3-11-25-21(18)24/h1-11,13H,12H2,(H,26,28)
InChIKey WAPCWZJUYLRLAB-UHFFFAOYSA-N
Mol Weight 468.74 g/mol
Molecular Formula C22H15BrClN3O2
Exact Mass 467.003617 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AvA25kIaMjW
Name 2-[1-(4-Bromobenzoyl)indol-3-yl]-N-(2-chloro-3-pyridyl)acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 467.003617433 u
Formula C22H15BrClN3O2
InChI InChI=1S/C22H15BrClN3O2/c23-16-9-7-14(8-10-16)22(29)27-13-15(17-4-1-2-6-19(17)27)12-20(28)26-18-5-3-11-25-21(18)24/h1-11,13H,12H2,(H,26,28)
InChIKey WAPCWZJUYLRLAB-UHFFFAOYSA-N
Molecular Weight 468.738 g/mol
SMILES C=1N(C2=C(C1CC(NC=1C(=NC=CC1)Cl)=O)C=CC=C2)C(C=1C=CC(=CC1)Br)=O