2-[2-[4-butoxy-2,3-bis(fluoranyl)phenyl]ethynyl]-5-hexyl-pyridine

Systemtic Name: 2-[2-[4-butoxy-2,3-bis(fluoranyl)phenyl]ethynyl]-5-hexyl-pyridine Openeye Name: 2-[2-(4-butoxy-2,3-difluoro-phenyl)ethynyl]-5-hexyl-pyridine CAS Name: 2-[2-(4-butoxy-2,3-difluorophenyl)ethynyl]-5-hexylpyridine IUPAC Name: 2-[2-(4-butoxy-2,3-difluorophenyl)ethynyl]-5-hexylpyridine Traditional Name: 2-[2-(4-butoxy-2,3-difluoro-phenyl)ethynyl]-5-hexyl-pyridine Formula: C23H27F2NO MolecularWeight: 371.463386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(C=C1)C#CC2=C(C(=C(C=C2)OCCCC)F)F

Isomeric SMILES

CCCCCCC1=CN=C(C=C1)C#CC2=C(C(=C(C=C2)OCCCC)F)F

InChI

InChI=1S/C23H27F2NO/c1-3-5-7-8-9-18-10-13-20(26-17-18)14-11-19-12-15-21(23(25)22(19)24)27-16-6-4-2/h10,12-13,15,17H,3-9,16H2,1-2H3