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

Systemtic Name: 2-[2-(4-heptylphenyl)ethynyl]-5-pentoxy-pyridine Openeye Name: 2-[2-(4-heptylphenyl)ethynyl]-5-pentoxy-pyridine CAS Name: 2-[2-(4-heptylphenyl)ethynyl]-5-pentoxypyridine IUPAC Name: 2-[2-(4-heptylphenyl)ethynyl]-5-pentoxypyridine Traditional Name: 5-amoxy-2-[2-(4-heptylphenyl)ethynyl]pyridine Formula: C25H33NO MolecularWeight: 363.53562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33NO/c1-3-5-7-8-9-11-22-12-14-23(15-13-22)16-17-24-18-19-25(21-26-24)27-20-10-6-4-2/h12-15,18-19,21H,3-11,20H2,1-2H3