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4-quinolinecarboxamide, N-[4-(aminocarbonyl)phenyl]-2-(3-methylphenyl)-
SpectraBase Compound ID JdPOTRxdb3v
InChI InChI=1S/C24H19N3O2/c1-15-5-4-6-17(13-15)22-14-20(19-7-2-3-8-21(19)27-22)24(29)26-18-11-9-16(10-12-18)23(25)28/h2-14H,1H3,(H2,25,28)(H,26,29)
InChIKey PLIIPGYPZSPCOI-UHFFFAOYSA-N
Mol Weight 381.44 g/mol
Molecular Formula C24H19N3O2
Exact Mass 381.147727 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 67oLJQ5xjAV
Name 4-Quinolinecarboxamide, N-[4-(aminocarbonyl)phenyl]-2-(3-methylphenyl)-
Comments Computed using HOSE algorithm
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Exact Mass 381.147726862 u
Formula C24H19N3O2
InChI InChI=1S/C24H19N3O2/c1-15-5-4-6-17(13-15)22-14-20(19-7-2-3-8-21(19)27-22)24(29)26-18-11-9-16(10-12-18)23(25)28/h2-14H,1H3,(H2,25,28)(H,26,29)
InChIKey PLIIPGYPZSPCOI-UHFFFAOYSA-N
Molecular Weight 381.435 g/mol
SMILES N(C(C=1C=C(C2=CC(C)=CC=C2)N=C2C1C=CC=C2)=O)C1=CC=C(C(=O)N)C=C1