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N-(2,3-dichlorophenyl)-2-(3-methylphenyl)-4-quinolinecarboxamide
SpectraBase Compound ID 2tsHdBb4zMk
InChI InChI=1S/C23H16Cl2N2O/c1-14-6-4-7-15(12-14)21-13-17(16-8-2-3-10-19(16)26-21)23(28)27-20-11-5-9-18(24)22(20)25/h2-13H,1H3,(H,27,28)
InChIKey VUZRKXRFAKLAPQ-UHFFFAOYSA-N
Mol Weight 407.3 g/mol
Molecular Formula C23H16Cl2N2O
Exact Mass 406.063969 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 99XOa3n0O6a
Name N-(2,3-Dichlorophenyl)-2-(3-methylphenyl)-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 406.063968542 u
Formula C23H16Cl2N2O
InChI InChI=1S/C23H16Cl2N2O/c1-14-6-4-7-15(12-14)21-13-17(16-8-2-3-10-19(16)26-21)23(28)27-20-11-5-9-18(24)22(20)25/h2-13H,1H3,(H,27,28)
InChIKey VUZRKXRFAKLAPQ-UHFFFAOYSA-N
Molecular Weight 407.300 g/mol
SMILES N(C(C=1C=C(C2=CC(C)=CC=C2)N=C2C1C=CC=C2)=O)C=1C(=C(Cl)C=CC1)Cl