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Ethyl anti-2,6-bis(4-cyanophenyl)-1,2,5,6-tetrahydro-1-phenyl-4-(phenylamino)pyridine-3-carboxylate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Ethyl anti-2,6-bis(4-cyanophenyl)-1,2,5,6-tetrahydro-1-phenyl-4-(phenylamino)pyridine-3-carboxylate
SpectraBase Compound ID A0diV4nybEd
InChI InChI=1S/C34H28N4O2/c1-2-40-34(39)32-30(37-28-9-5-3-6-10-28)21-31(26-17-13-24(22-35)14-18-26)38(29-11-7-4-8-12-29)33(32)27-19-15-25(23-36)16-20-27/h3-20,31,33,37H,2,21H2,1H3/t31-,33+/m0/s1
InChIKey ZYNUMMGKPYOCNT-CQTOTRCISA-N
Mol Weight 524.6 g/mol
Molecular Formula C34H28N4O2
Exact Mass 524.221226 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CXRUPtuSeC5
Name Ethyl anti-2,6-bis(4-cyanophenyl)-1,2,5,6-tetrahydro-1-phenyl-4-(phenylamino)pyridine-3-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 524.221226156 u
Formula C34H28N4O2
InChI InChI=1S/C34H28N4O2/c1-2-40-34(39)32-30(37-28-9-5-3-6-10-28)21-31(26-17-13-24(22-35)14-18-26)38(29-11-7-4-8-12-29)33(32)27-19-15-25(23-36)16-20-27/h3-20,31,33,37H,2,21H2,1H3/t31-,33+/m0/s1
InChIKey ZYNUMMGKPYOCNT-CQTOTRCISA-N
Molecular Weight 524.624 g/mol
SMILES C1[C@](N([C@@](C(=C1NC1=CC=CC=C1)C(OCC)=O)(C1=CC=C(C=C1)C#N)[H])C1=CC=CC=C1)(C1=CC=C(C=C1)C#N)[H]