2-[2-(4-octoxyphenyl)ethynyl]-5-pentyl-pyridine

Systemtic Name: 2-[2-(4-octoxyphenyl)ethynyl]-5-pentyl-pyridine Openeye Name: 2-[2-(4-octoxyphenyl)ethynyl]-5-pentyl-pyridine CAS Name: 2-[2-(4-octoxyphenyl)ethynyl]-5-pentylpyridine IUPAC Name: 2-[2-(4-octoxyphenyl)ethynyl]-5-pentylpyridine Traditional Name: 5-amyl-2-[2-(4-octoxyphenyl)ethynyl]pyridine Formula: C26H35NO MolecularWeight: 377.5622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C#CC2=NC=C(C=C2)CCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C#CC2=NC=C(C=C2)CCCCC

InChI

InChI=1S/C26H35NO/c1-3-5-7-8-9-11-21-28-26-19-15-23(16-20-26)13-17-25-18-14-24(22-27-25)12-10-6-4-2/h14-16,18-20,22H,3-12,21H2,1-2H3