3-bromanyl-2-fluoranyl-6-(4-octoxyphenyl)benzenecarbonitrile

Systemtic Name: 3-bromanyl-2-fluoranyl-6-(4-octoxyphenyl)benzenecarbonitrile Openeye Name: 3-bromo-2-fluoro-6-(4-octoxyphenyl)benzonitrile CAS Name: 3-bromo-2-fluoro-6-(4-octoxyphenyl)benzonitrile IUPAC Name: 3-bromo-2-fluoro-6-(4-octoxyphenyl)benzonitrile Traditional Name: 3-bromo-2-fluoro-6-(4-octoxyphenyl)benzonitrile Formula: C21H23BrFNO MolecularWeight: 404.315823

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)Br)F)C#N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)Br)F)C#N

InChI

InChI=1S/C21H23BrFNO/c1-2-3-4-5-6-7-14-25-17-10-8-16(9-11-17)18-12-13-20(22)21(23)19(18)15-24/h8-13H,2-7,14H2,1H3