2-[4-(3-fluoranyl-4-hexoxy-phenyl)phenoxy]propanenitrile

Systemtic Name: 2-[4-(3-fluoranyl-4-hexoxy-phenyl)phenoxy]propanenitrile Openeye Name: 2-[4-(3-fluoro-4-hexoxy-phenyl)phenoxy]propanenitrile CAS Name: 2-[4-(3-fluoro-4-hexoxyphenyl)phenoxy]propanenitrile IUPAC Name: 2-[4-(3-fluoro-4-hexoxyphenyl)phenoxy]propanenitrile Traditional Name: 2-[4-(3-fluoro-4-hexoxy-phenyl)phenoxy]propionitrile Formula: C21H24FNO2 MolecularWeight: 341.419163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C2=CC=C(C=C2)OC(C)C#N)F

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C2=CC=C(C=C2)OC(C)C#N)F

InChI

InChI=1S/C21H24FNO2/c1-3-4-5-6-13-24-21-12-9-18(14-20(21)22)17-7-10-19(11-8-17)25-16(2)15-23/h7-12,14,16H,3-6,13H2,1-2H3