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

Systemtic Name: 5-octoxy-2-[2-(4-octylphenyl)ethynyl]pyridine Openeye Name: 5-octoxy-2-[2-(4-octylphenyl)ethynyl]pyridine CAS Name: 5-octoxy-2-[2-(4-octylphenyl)ethynyl]pyridine IUPAC Name: 5-octoxy-2-[2-(4-octylphenyl)ethynyl]pyridine Traditional Name: 5-octoxy-2-[2-(4-octylphenyl)ethynyl]pyridine Formula: C29H41NO MolecularWeight: 419.64194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H41NO/c1-3-5-7-9-11-13-15-26-16-18-27(19-17-26)20-21-28-22-23-29(25-30-28)31-24-14-12-10-8-6-4-2/h16-19,22-23,25H,3-15,24H2,1-2H3