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2-(2-chlorophenyl)-N-(4-isopropylphenyl)-4-quinolinecarboxamide

View entire compound with spectra: 2 NMR

2-(2-chlorophenyl)-N-(4-isopropylphenyl)-4-quinolinecarboxamide
SpectraBase Compound ID 1b2KZDlftbq
InChI InChI=1S/C25H21ClN2O/c1-16(2)17-11-13-18(14-12-17)27-25(29)21-15-24(20-8-3-5-9-22(20)26)28-23-10-6-4-7-19(21)23/h3-16H,1-2H3,(H,27,29)
InChIKey USXVEXULOPFLCQ-UHFFFAOYSA-N
Mol Weight 400.91 g/mol
Molecular Formula C25H21ClN2O
Exact Mass 400.134241 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D3ZjzLTXPiy
Name 2-(2-Chlorophenyl)-N-(4-isopropylphenyl)-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 400.134241003 u
Formula C25H21ClN2O
InChI InChI=1S/C25H21ClN2O/c1-16(2)17-11-13-18(14-12-17)27-25(29)21-15-24(20-8-3-5-9-22(20)26)28-23-10-6-4-7-19(21)23/h3-16H,1-2H3,(H,27,29)
InChIKey USXVEXULOPFLCQ-UHFFFAOYSA-N
Molecular Weight 400.909 g/mol
SMILES N(C(C=1C=C(N=C2C=CC=CC12)C1=C(Cl)C=CC=C1)=O)C1=CC=C(C=C1)C(C)C