2-[2-(4-heptylphenyl)ethynyl]-5-hexoxy-pyridine

Systemtic Name: 2-[2-(4-heptylphenyl)ethynyl]-5-hexoxy-pyridine Openeye Name: 2-[2-(4-heptylphenyl)ethynyl]-5-hexoxy-pyridine CAS Name: 2-[2-(4-heptylphenyl)ethynyl]-5-hexoxypyridine IUPAC Name: 2-[2-(4-heptylphenyl)ethynyl]-5-hexoxypyridine Traditional Name: 2-[2-(4-heptylphenyl)ethynyl]-5-hexoxy-pyridine Formula: C26H35NO MolecularWeight: 377.5622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=C2)OCCCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=C2)OCCCCCC

InChI

InChI=1S/C26H35NO/c1-3-5-7-9-10-12-23-13-15-24(16-14-23)17-18-25-19-20-26(22-27-25)28-21-11-8-6-4-2/h13-16,19-20,22H,3-12,21H2,1-2H3