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N-(1,3-benzodioxol-5-yl)-2-(3-propoxyphenyl)-4-quinolinecarboxamide
SpectraBase Compound ID LH7eREMHDiL
InChI InChI=1S/C26H22N2O4/c1-2-12-30-19-7-5-6-17(13-19)23-15-21(20-8-3-4-9-22(20)28-23)26(29)27-18-10-11-24-25(14-18)32-16-31-24/h3-11,13-15H,2,12,16H2,1H3,(H,27,29)
InChIKey WXCVSNZXVLHGAM-UHFFFAOYSA-N
Mol Weight 426.47 g/mol
Molecular Formula C26H22N2O4
Exact Mass 426.157957 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FlJJxiRtPX8
Name N-(1,3-Benzodioxol-5-yl)-2-(3-propoxyphenyl)-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 426.157957192 u
Formula C26H22N2O4
InChI InChI=1S/C26H22N2O4/c1-2-12-30-19-7-5-6-17(13-19)23-15-21(20-8-3-4-9-22(20)28-23)26(29)27-18-10-11-24-25(14-18)32-16-31-24/h3-11,13-15H,2,12,16H2,1H3,(H,27,29)
InChIKey WXCVSNZXVLHGAM-UHFFFAOYSA-N
Molecular Weight 426.472 g/mol
SMILES N(C=1C=C2C(OCO2)=CC1)C(C1=CC(C2=CC(OCCC)=CC=C2)=NC=2C1=CC=CC2)=O