2-[2-[2,3-bis(fluoranyl)-4-pentoxy-phenyl]ethynyl]-5-propyl-pyridine

Systemtic Name: 2-[2-[2,3-bis(fluoranyl)-4-pentoxy-phenyl]ethynyl]-5-propyl-pyridine Openeye Name: 2-[2-(2,3-difluoro-4-pentoxy-phenyl)ethynyl]-5-propyl-pyridine CAS Name: 2-[2-(2,3-difluoro-4-pentoxyphenyl)ethynyl]-5-propylpyridine IUPAC Name: 2-[2-(2,3-difluoro-4-pentoxyphenyl)ethynyl]-5-propylpyridine Traditional Name: 2-[2-(4-amoxy-2,3-difluoro-phenyl)ethynyl]-5-propyl-pyridine Formula: C21H23F2NO MolecularWeight: 343.410226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C(=C(C=C1)C#CC2=NC=C(C=C2)CCC)F)F

Isomeric SMILES

CCCCCOC1=C(C(=C(C=C1)C#CC2=NC=C(C=C2)CCC)F)F

InChI

InChI=1S/C21H23F2NO/c1-3-5-6-14-25-19-13-10-17(20(22)21(19)23)9-12-18-11-8-16(7-4-2)15-24-18/h8,10-11,13,15H,3-7,14H2,1-2H3