2-[2-(4-ethoxyphenyl)ethynyl]-5-octyl-pyridine

Systemtic Name: 2-[2-(4-ethoxyphenyl)ethynyl]-5-octyl-pyridine Openeye Name: 2-[2-(4-ethoxyphenyl)ethynyl]-5-octyl-pyridine CAS Name: 2-[2-(4-ethoxyphenyl)ethynyl]-5-octylpyridine IUPAC Name: 2-[2-(4-ethoxyphenyl)ethynyl]-5-octylpyridine Traditional Name: 5-octyl-2-(2-p-phenetylethynyl)pyridine Formula: C23H29NO MolecularWeight: 335.48246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(C=C1)C#CC2=CC=C(C=C2)OCC

Isomeric SMILES

CCCCCCCCC1=CN=C(C=C1)C#CC2=CC=C(C=C2)OCC

InChI

InChI=1S/C23H29NO/c1-3-5-6-7-8-9-10-21-12-16-22(24-19-21)15-11-20-13-17-23(18-14-20)25-4-2/h12-14,16-19H,3-10H2,1-2H3