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

Systemtic Name: 2-[2-[4-ethoxy-2,3-bis(fluoranyl)phenyl]ethynyl]-5-heptyl-pyridine Openeye Name: 2-[2-(4-ethoxy-2,3-difluoro-phenyl)ethynyl]-5-heptyl-pyridine CAS Name: 2-[2-(4-ethoxy-2,3-difluorophenyl)ethynyl]-5-heptylpyridine IUPAC Name: 2-[2-(4-ethoxy-2,3-difluorophenyl)ethynyl]-5-heptylpyridine Traditional Name: 2-[2-(4-ethoxy-2,3-difluoro-phenyl)ethynyl]-5-heptyl-pyridine Formula: C22H25F2NO MolecularWeight: 357.436806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25F2NO/c1-3-5-6-7-8-9-17-10-13-19(25-16-17)14-11-18-12-15-20(26-4-2)22(24)21(18)23/h10,12-13,15-16H,3-9H2,1-2H3