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

Systemtic Name: 2-[2-[4-butoxy-2,3-bis(fluoranyl)phenyl]ethynyl]-5-methyl-pyridine Openeye Name: 2-[2-(4-butoxy-2,3-difluoro-phenyl)ethynyl]-5-methyl-pyridine CAS Name: 2-[2-(4-butoxy-2,3-difluorophenyl)ethynyl]-5-methylpyridine IUPAC Name: 2-[2-(4-butoxy-2,3-difluorophenyl)ethynyl]-5-methylpyridine Traditional Name: 2-[2-(4-butoxy-2,3-difluoro-phenyl)ethynyl]-5-methyl-pyridine Formula: C18H17F2NO MolecularWeight: 301.330486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=C(C=C1)C#CC2=NC=C(C=C2)C)F)F

Isomeric SMILES

CCCCOC1=C(C(=C(C=C1)C#CC2=NC=C(C=C2)C)F)F

InChI

InChI=1S/C18H17F2NO/c1-3-4-11-22-16-10-7-14(17(19)18(16)20)6-9-15-8-5-13(2)12-21-15/h5,7-8,10,12H,3-4,11H2,1-2H3