2-phenyl-6-pyridin-2-yl-4-[2-(3,4,5-tridodecoxyphenyl)ethynyl]pyridine

Systemtic Name: 2-phenyl-6-pyridin-2-yl-4-[2-(3,4,5-tridodecoxyphenyl)ethynyl]pyridine Openeye Name: 2-phenyl-6-(2-pyridyl)-4-[2-(3,4,5-tridodecoxyphenyl)ethynyl]pyridine CAS Name: 2-phenyl-6-(2-pyridinyl)-4-[2-(3,4,5-tridodecoxyphenyl)ethynyl]pyridine IUPAC Name: 2-phenyl-6-pyridin-2-yl-4-[2-(3,4,5-tridodecoxyphenyl)ethynyl]pyridine Traditional Name: 2-phenyl-6-(2-pyridyl)-4-[2-(3,4,5-trilauryloxyphenyl)ethynyl]pyridine Formula: C60H88N2O3 MolecularWeight: 885.35232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC(=CC(=C1OCCCCCCCCCCCC)OCCCCCCCCCCCC)C#CC2=CC(=NC(=C2)C3=CC=CC=N3)C4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCCCCOC1=CC(=CC(=C1OCCCCCCCCCCCC)OCCCCCCCCCCCC)C#CC2=CC(=NC(=C2)C3=CC=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C60H88N2O3/c1-4-7-10-13-16-19-22-25-28-36-45-63-58-50-53(43-42-52-48-56(54-39-32-31-33-40-54)62-57(49-52)55-41-34-35-44-61-55)51-59(64-46-37-29-26-23-20-17-14-11-8-5-2)60(58)65-47-38-30-27-24-21-18-15-12-9-6-3/h31-35,39-41,44,48-51H,4-30,36-38,45-47H2,1-3H3