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N-(1,3-benzodioxol-5-ylmethyl)-2-(2-chlorophenyl)-4-quinolinecarboxamide

View entire compound with spectra: 2 NMR

N-(1,3-benzodioxol-5-ylmethyl)-2-(2-chlorophenyl)-4-quinolinecarboxamide
SpectraBase Compound ID FO04RHe4CR8
InChI InChI=1S/C24H17ClN2O3/c25-19-7-3-1-6-17(19)21-12-18(16-5-2-4-8-20(16)27-21)24(28)26-13-15-9-10-22-23(11-15)30-14-29-22/h1-12H,13-14H2,(H,26,28)
InChIKey FVVQJKKDWFBLPS-UHFFFAOYSA-N
Mol Weight 416.86 g/mol
Molecular Formula C24H17ClN2O3
Exact Mass 416.09277 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1MXAT8IY37S
Name N-(1,3-Benzodioxol-5-ylmethyl)-2-(2-chlorophenyl)-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 416.092770112 u
Formula C24H17ClN2O3
InChI InChI=1S/C24H17ClN2O3/c25-19-7-3-1-6-17(19)21-12-18(16-5-2-4-8-20(16)27-21)24(28)26-13-15-9-10-22-23(11-15)30-14-29-22/h1-12H,13-14H2,(H,26,28)
InChIKey FVVQJKKDWFBLPS-UHFFFAOYSA-N
Molecular Weight 416.864 g/mol
SMILES N(C(C=1C=C(N=C2C=CC=CC12)C1=C(Cl)C=CC=C1)=O)CC1=CC=2OCOC2C=C1