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2-(1,3-benzodioxol-5-yl)-N-(2-bromophenyl)-4-quinolinecarboxamide

View entire compound with spectra: 2 NMR

2-(1,3-benzodioxol-5-yl)-N-(2-bromophenyl)-4-quinolinecarboxamide
SpectraBase Compound ID Fre2uzzlHzO
InChI InChI=1S/C23H15BrN2O3/c24-17-6-2-4-8-19(17)26-23(27)16-12-20(25-18-7-3-1-5-15(16)18)14-9-10-21-22(11-14)29-13-28-21/h1-12H,13H2,(H,26,27)
InChIKey RSGBNNIVNJYJSZ-UHFFFAOYSA-N
Mol Weight 447.29 g/mol
Molecular Formula C23H15BrN2O3
Exact Mass 446.026605 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CwdV98tr60g
Name 2-(1,3-Benzodioxol-5-yl)-N-(2-bromophenyl)-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 446.026605348 u
Formula C23H15BrN2O3
InChI InChI=1S/C23H15BrN2O3/c24-17-6-2-4-8-19(17)26-23(27)16-12-20(25-18-7-3-1-5-15(16)18)14-9-10-21-22(11-14)29-13-28-21/h1-12H,13H2,(H,26,27)
InChIKey RSGBNNIVNJYJSZ-UHFFFAOYSA-N
Molecular Weight 447.288 g/mol
SMILES N(C=1C(Br)=CC=CC1)C(C1=CC(C2=CC=3OCOC3C=C2)=NC=2C1=CC=CC2)=O