5-butoxy-2-[2-(4-octylphenyl)ethynyl]pyridine

Systemtic Name: 5-butoxy-2-[2-(4-octylphenyl)ethynyl]pyridine Openeye Name: 5-butoxy-2-[2-(4-octylphenyl)ethynyl]pyridine CAS Name: 5-butoxy-2-[2-(4-octylphenyl)ethynyl]pyridine IUPAC Name: 5-butoxy-2-[2-(4-octylphenyl)ethynyl]pyridine Traditional Name: 5-butoxy-2-[2-(4-octylphenyl)ethynyl]pyridine Formula: C25H33NO MolecularWeight: 363.53562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=C2)OCCCC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=C2)OCCCC

InChI

InChI=1S/C25H33NO/c1-3-5-7-8-9-10-11-22-12-14-23(15-13-22)16-17-24-18-19-25(21-26-24)27-20-6-4-2/h12-15,18-19,21H,3-11,20H2,1-2H3