2-[2-(4-butylphenyl)ethynyl]-5-heptyl-pyridine

Systemtic Name: 2-[2-(4-butylphenyl)ethynyl]-5-heptyl-pyridine Openeye Name: 2-[2-(4-butylphenyl)ethynyl]-5-heptyl-pyridine CAS Name: 2-[2-(4-butylphenyl)ethynyl]-5-heptylpyridine IUPAC Name: 2-[2-(4-butylphenyl)ethynyl]-5-heptylpyridine Traditional Name: 2-[2-(4-butylphenyl)ethynyl]-5-heptyl-pyridine Formula: C24H31N MolecularWeight: 333.50964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(C=C1)C#CC2=CC=C(C=C2)CCCC

Isomeric SMILES

CCCCCCCC1=CN=C(C=C1)C#CC2=CC=C(C=C2)CCCC

InChI

InChI=1S/C24H31N/c1-3-5-7-8-9-11-23-17-19-24(25-20-23)18-16-22-14-12-21(13-15-22)10-6-4-2/h12-15,17,19-20H,3-11H2,1-2H3