2-[2-(4-hexylphenyl)ethynyl]-5-propyl-pyridine

Systemtic Name: 2-[2-(4-hexylphenyl)ethynyl]-5-propyl-pyridine Openeye Name: 2-[2-(4-hexylphenyl)ethynyl]-5-propyl-pyridine CAS Name: 2-[2-(4-hexylphenyl)ethynyl]-5-propylpyridine IUPAC Name: 2-[2-(4-hexylphenyl)ethynyl]-5-propylpyridine Traditional Name: 2-[2-(4-hexylphenyl)ethynyl]-5-propyl-pyridine Formula: C22H27N MolecularWeight: 305.45648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=C2)CCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=C2)CCC

InChI

InChI=1S/C22H27N/c1-3-5-6-7-9-19-10-12-20(13-11-19)14-16-22-17-15-21(8-4-2)18-23-22/h10-13,15,17-18H,3-9H2,1-2H3