4-(5-ethyl-1,3-dioxan-2-yl)-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-(5-ethyl-1,3-dioxan-2-yl)-2-fluoranyl-benzenecarbonitrile Openeye Name: 4-(5-ethyl-1,3-dioxan-2-yl)-2-fluoro-benzonitrile CAS Name: 4-(5-ethyl-1,3-dioxan-2-yl)-2-fluorobenzonitrile IUPAC Name: 4-(5-ethyl-1,3-dioxan-2-yl)-2-fluorobenzonitrile Traditional Name: 4-(5-ethyl-1,3-dioxan-2-yl)-2-fluoro-benzonitrile Formula: C13H14FNO2 MolecularWeight: 235.254163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1COC(OC1)C2=CC(=C(C=C2)C#N)F

Isomeric SMILES

CCC1COC(OC1)C2=CC(=C(C=C2)C#N)F

InChI

InChI=1S/C13H14FNO2/c1-2-9-7-16-13(17-8-9)10-3-4-11(6-15)12(14)5-10/h3-5,9,13H,2,7-8H2,1H3