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

Systemtic Name: 2-[2-(4-butylphenyl)ethynyl]-5-hexyl-pyridine Openeye Name: 2-[2-(4-butylphenyl)ethynyl]-5-hexyl-pyridine CAS Name: 2-[2-(4-butylphenyl)ethynyl]-5-hexylpyridine IUPAC Name: 2-[2-(4-butylphenyl)ethynyl]-5-hexylpyridine Traditional Name: 2-[2-(4-butylphenyl)ethynyl]-5-hexyl-pyridine Formula: C23H29N MolecularWeight: 319.48306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(C=C1)C#CC2=CC=C(C=C2)CCCC

Isomeric SMILES

CCCCCCC1=CN=C(C=C1)C#CC2=CC=C(C=C2)CCCC

InChI

InChI=1S/C23H29N/c1-3-5-7-8-10-22-16-18-23(24-19-22)17-15-21-13-11-20(12-14-21)9-6-4-2/h11-14,16,18-19H,3-10H2,1-2H3