2-[2-(4-butylphenyl)ethynyl]-5-octoxy-pyridine

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(C=C1)C#CC2=CC=C(C=C2)CCCC

Isomeric SMILES

CCCCCCCCOC1=CN=C(C=C1)C#CC2=CC=C(C=C2)CCCC

InChI

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