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3-N-Butyl-5-[2-[4-chlorophenyl]-6,8-dimethyl-4-quinolyl]-2-N-octyloxazolidine

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3-N-Butyl-5-[2-[4-chlorophenyl]-6,8-dimethyl-4-quinolyl]-2-N-octyloxazolidine
SpectraBase Compound ID GWj4qLfBMR3
InChI InChI=1S/C32H43ClN2O/c1-5-7-9-10-11-12-13-31-35(18-8-6-2)22-30(36-31)27-21-29(25-14-16-26(33)17-15-25)34-32-24(4)19-23(3)20-28(27)32/h14-17,19-21,30-31H,5-13,18,22H2,1-4H3
InChIKey WWPXGKKBMAZOAQ-UHFFFAOYSA-N
Mol Weight 507.2 g/mol
Molecular Formula C32H43ClN2O
Exact Mass 506.306392 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IbXvFKTrHg3
Name 3-N-Butyl-5-[2-[4-chlorophenyl]-6,8-dimethyl-4-quinolyl]-2-N-octyloxazolidine
Comments Computed using HOSE algorithm
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Exact Mass 506.306391712 u
Formula C32H43ClN2O
InChI InChI=1S/C32H43ClN2O/c1-5-7-9-10-11-12-13-31-35(18-8-6-2)22-30(36-31)27-21-29(25-14-16-26(33)17-15-25)34-32-24(4)19-23(3)20-28(27)32/h14-17,19-21,30-31H,5-13,18,22H2,1-4H3
InChIKey WWPXGKKBMAZOAQ-UHFFFAOYSA-N
Molecular Weight 507.162 g/mol
SMILES C1=2C(=CC(=CC2C)C)C(=CC(=N1)C1=CC=C(C=C1)Cl)C1OC(N(CCCC)C1)CCCCCCCC