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

Systemtic Name: 2-[2-(4-heptylphenyl)ethynyl]-5-methoxy-pyridine Openeye Name: 2-[2-(4-heptylphenyl)ethynyl]-5-methoxy-pyridine CAS Name: 2-[2-(4-heptylphenyl)ethynyl]-5-methoxypyridine IUPAC Name: 2-[2-(4-heptylphenyl)ethynyl]-5-methoxypyridine Traditional Name: 2-[2-(4-heptylphenyl)ethynyl]-5-methoxy-pyridine Formula: C21H25NO MolecularWeight: 307.4293

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO/c1-3-4-5-6-7-8-18-9-11-19(12-10-18)13-14-20-15-16-21(23-2)17-22-20/h9-12,15-17H,3-8H2,1-2H3