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2-(2-ethoxyphenyl)-N-(4-pyridinylmethyl)-4-quinolinecarboxamide
SpectraBase Compound ID ItbHuGYTYxN
InChI InChI=1S/C24H21N3O2/c1-2-29-23-10-6-4-8-19(23)22-15-20(18-7-3-5-9-21(18)27-22)24(28)26-16-17-11-13-25-14-12-17/h3-15H,2,16H2,1H3,(H,26,28)
InChIKey VNXBKXUWUIRPGN-UHFFFAOYSA-N
Mol Weight 383.45 g/mol
Molecular Formula C24H21N3O2
Exact Mass 383.163377 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3zaMsl0sEMs
Name 2-(2-Ethoxyphenyl)-N-(4-pyridinylmethyl)-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 383.163376926 u
Formula C24H21N3O2
InChI InChI=1S/C24H21N3O2/c1-2-29-23-10-6-4-8-19(23)22-15-20(18-7-3-5-9-21(18)27-22)24(28)26-16-17-11-13-25-14-12-17/h3-15H,2,16H2,1H3,(H,26,28)
InChIKey VNXBKXUWUIRPGN-UHFFFAOYSA-N
Molecular Weight 383.451 g/mol
SMILES N(CC=1C=CN=CC1)C(C1=CC(=NC2=CC=CC=C12)C1=C(OCC)C=CC=C1)=O