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

Systemtic Name: 2-[2-[4-butoxy-2,3-bis(fluoranyl)phenyl]ethynyl]-5-heptyl-pyridine Openeye Name: 2-[2-(4-butoxy-2,3-difluoro-phenyl)ethynyl]-5-heptyl-pyridine CAS Name: 2-[2-(4-butoxy-2,3-difluorophenyl)ethynyl]-5-heptylpyridine IUPAC Name: 2-[2-(4-butoxy-2,3-difluorophenyl)ethynyl]-5-heptylpyridine Traditional Name: 2-[2-(4-butoxy-2,3-difluoro-phenyl)ethynyl]-5-heptyl-pyridine Formula: C24H29F2NO MolecularWeight: 385.489966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(C=C1)C#CC2=C(C(=C(C=C2)OCCCC)F)F

Isomeric SMILES

CCCCCCCC1=CN=C(C=C1)C#CC2=C(C(=C(C=C2)OCCCC)F)F

InChI

InChI=1S/C24H29F2NO/c1-3-5-7-8-9-10-19-11-14-21(27-18-19)15-12-20-13-16-22(24(26)23(20)25)28-17-6-4-2/h11,13-14,16,18H,3-10,17H2,1-2H3