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

Systemtic Name: 2-[2-(4-octylphenyl)ethynyl]-5-pentyl-pyridine Openeye Name: 2-[2-(4-octylphenyl)ethynyl]-5-pentyl-pyridine CAS Name: 2-[2-(4-octylphenyl)ethynyl]-5-pentylpyridine IUPAC Name: 2-[2-(4-octylphenyl)ethynyl]-5-pentylpyridine Traditional Name: 5-amyl-2-[2-(4-octylphenyl)ethynyl]pyridine Formula: C26H35N MolecularWeight: 361.5628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=C2)CCCCC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=C2)CCCCC

InChI

InChI=1S/C26H35N/c1-3-5-7-8-9-11-12-23-14-16-24(17-15-23)18-20-26-21-19-25(22-27-26)13-10-6-4-2/h14-17,19,21-22H,3-13H2,1-2H3