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2-quinolinecarboxamide, N-[2-[(3,4,5-trimethoxybenzoyl)amino]ethyl]-
SpectraBase Compound ID 4Ns0Se31FH0
InChI InChI=1S/C22H23N3O5/c1-28-18-12-15(13-19(29-2)20(18)30-3)21(26)23-10-11-24-22(27)17-9-8-14-6-4-5-7-16(14)25-17/h4-9,12-13H,10-11H2,1-3H3,(H,23,26)(H,24,27)
InChIKey RVMBGTQAQSIJEF-UHFFFAOYSA-N
Mol Weight 409.44 g/mol
Molecular Formula C22H23N3O5
Exact Mass 409.163771 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Av2MaFBFfos
Name 2-Quinolinecarboxamide, N-[2-[(3,4,5-trimethoxybenzoyl)amino]ethyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 409.163770848 u
Formula C22H23N3O5
InChI InChI=1S/C22H23N3O5/c1-28-18-12-15(13-19(29-2)20(18)30-3)21(26)23-10-11-24-22(27)17-9-8-14-6-4-5-7-16(14)25-17/h4-9,12-13H,10-11H2,1-3H3,(H,23,26)(H,24,27)
InChIKey RVMBGTQAQSIJEF-UHFFFAOYSA-N
Molecular Weight 409.442 g/mol
SMILES N(C(C1=NC=2C(C=C1)=CC=CC2)=O)CCNC(C1=CC(OC)=C(C(=C1)OC)OC)=O