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

Systemtic Name: 2-[2-(4-hexylphenyl)ethynyl]-5-octoxy-pyridine Openeye Name: 2-[2-(4-hexylphenyl)ethynyl]-5-octoxy-pyridine CAS Name: 2-[2-(4-hexylphenyl)ethynyl]-5-octoxypyridine IUPAC Name: 2-[2-(4-hexylphenyl)ethynyl]-5-octoxypyridine Traditional Name: 2-[2-(4-hexylphenyl)ethynyl]-5-octoxy-pyridine Formula: C27H37NO MolecularWeight: 391.58878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H37NO/c1-3-5-7-9-10-12-22-29-27-21-20-26(28-23-27)19-18-25-16-14-24(15-17-25)13-11-8-6-4-2/h14-17,20-21,23H,3-13,22H2,1-2H3