2,3-bis(fluoranyl)-4-(4-octylphenyl)benzenecarbonitrile

Systemtic Name: 2,3-bis(fluoranyl)-4-(4-octylphenyl)benzenecarbonitrile Openeye Name: 2,3-difluoro-4-(4-octylphenyl)benzonitrile CAS Name: 2,3-difluoro-4-(4-octylphenyl)benzonitrile IUPAC Name: 2,3-difluoro-4-(4-octylphenyl)benzonitrile Traditional Name: 2,3-difluoro-4-(4-octylphenyl)benzonitrile Formula: C21H23F2N MolecularWeight: 327.410826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=C(C(=C(C=C2)C#N)F)F

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=C(C(=C(C=C2)C#N)F)F

InChI

InChI=1S/C21H23F2N/c1-2-3-4-5-6-7-8-16-9-11-17(12-10-16)19-14-13-18(15-24)20(22)21(19)23/h9-14H,2-8H2,1H3