2-(4-chloranyl-3-fluoranyl-phenyl)-5-[2-(5-pentyl-1,3-dioxan-2-yl)ethynyl]pyridine

Systemtic Name: 2-(4-chloranyl-3-fluoranyl-phenyl)-5-[2-(5-pentyl-1,3-dioxan-2-yl)ethynyl]pyridine Openeye Name: 2-(4-chloro-3-fluoro-phenyl)-5-[2-(5-pentyl-1,3-dioxan-2-yl)ethynyl]pyridine CAS Name: 2-(4-chloro-3-fluorophenyl)-5-[2-(5-pentyl-1,3-dioxan-2-yl)ethynyl]pyridine IUPAC Name: 2-(4-chloro-3-fluorophenyl)-5-[2-(5-pentyl-1,3-dioxan-2-yl)ethynyl]pyridine Traditional Name: 5-[2-(5-amyl-1,3-dioxan-2-yl)ethynyl]-2-(4-chloro-3-fluoro-phenyl)pyridine Formula: C22H23ClFNO2 MolecularWeight: 387.874923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1COC(OC1)C#CC2=CN=C(C=C2)C3=CC(=C(C=C3)Cl)F

Isomeric SMILES

CCCCCC1COC(OC1)C#CC2=CN=C(C=C2)C3=CC(=C(C=C3)Cl)F

InChI

InChI=1S/C22H23ClFNO2/c1-2-3-4-5-17-14-26-22(27-15-17)11-7-16-6-10-21(25-13-16)18-8-9-19(23)20(24)12-18/h6,8-10,12-13,17,22H,2-5,14-15H2,1H3