4-[4-(1,4-dioxaspiro[4.5]decan-8-yl)cyclohexyl]-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[4-(1,4-dioxaspiro[4.5]decan-8-yl)cyclohexyl]-2-fluoranyl-benzenecarbonitrile Openeye Name: 4-[4-(1,4-dioxaspiro[4.5]decan-8-yl)cyclohexyl]-2-fluoro-benzonitrile CAS Name: 4-[4-(1,4-dioxaspiro[4.5]decan-8-yl)cyclohexyl]-2-fluorobenzonitrile IUPAC Name: 4-[4-(1,4-dioxaspiro[4.5]decan-8-yl)cyclohexyl]-2-fluorobenzonitrile Traditional Name: 4-[4-(1,4-dioxaspiro[4.5]decan-8-yl)cyclohexyl]-2-fluoro-benzonitrile Formula: C21H26FNO2 MolecularWeight: 343.435043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2CCC3(CC2)OCCO3)C4=CC(=C(C=C4)C#N)F

Isomeric SMILES

C1CC(CCC1C2CCC3(CC2)OCCO3)C4=CC(=C(C=C4)C#N)F

InChI

InChI=1S/C21H26FNO2/c22-20-13-18(5-6-19(20)14-23)16-3-1-15(2-4-16)17-7-9-21(10-8-17)24-11-12-25-21/h5-6,13,15-17H,1-4,7-12H2