2-[2,3-bis(fluoranyl)-4-(4-heptoxyphenyl)phenoxy]propanenitrile

Systemtic Name: 2-[2,3-bis(fluoranyl)-4-(4-heptoxyphenyl)phenoxy]propanenitrile Openeye Name: 2-[2,3-difluoro-4-(4-heptoxyphenyl)phenoxy]propanenitrile CAS Name: 2-[2,3-difluoro-4-(4-heptoxyphenyl)phenoxy]propanenitrile IUPAC Name: 2-[2,3-difluoro-4-(4-heptoxyphenyl)phenoxy]propanenitrile Traditional Name: 2-[2,3-difluoro-4-(4-heptoxyphenyl)phenoxy]propionitrile Formula: C22H25F2NO2 MolecularWeight: 373.436206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)OC(C)C#N)F)F

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)OC(C)C#N)F)F

InChI

InChI=1S/C22H25F2NO2/c1-3-4-5-6-7-14-26-18-10-8-17(9-11-18)19-12-13-20(22(24)21(19)23)27-16(2)15-25/h8-13,16H,3-7,14H2,1-2H3