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

Systemtic Name: 2-[2-(4-hexylphenyl)ethynyl]-5-octyl-pyridine Openeye Name: 2-[2-(4-hexylphenyl)ethynyl]-5-octyl-pyridine CAS Name: 2-[2-(4-hexylphenyl)ethynyl]-5-octylpyridine IUPAC Name: 2-[2-(4-hexylphenyl)ethynyl]-5-octylpyridine Traditional Name: 2-[2-(4-hexylphenyl)ethynyl]-5-octyl-pyridine Formula: C27H37N MolecularWeight: 375.58938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H37N/c1-3-5-7-9-10-12-14-26-20-22-27(28-23-26)21-19-25-17-15-24(16-18-25)13-11-8-6-4-2/h15-18,20,22-23H,3-14H2,1-2H3