4-[2-(3-fluorophenyl)-5-nonoxy-phenyl]benzenecarbonitrile

Systemtic Name: 4-[2-(3-fluorophenyl)-5-nonoxy-phenyl]benzenecarbonitrile Openeye Name: 4-[2-(3-fluorophenyl)-5-nonoxy-phenyl]benzonitrile CAS Name: 4-[2-(3-fluorophenyl)-5-nonoxyphenyl]benzonitrile IUPAC Name: 4-[2-(3-fluorophenyl)-5-nonoxyphenyl]benzonitrile Traditional Name: 4-[2-(3-fluorophenyl)-5-nonoxy-phenyl]benzonitrile Formula: C28H30FNO MolecularWeight: 415.542303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC(=C(C=C1)C2=CC(=CC=C2)F)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCCCCOC1=CC(=C(C=C1)C2=CC(=CC=C2)F)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C28H30FNO/c1-2-3-4-5-6-7-8-18-31-26-16-17-27(24-10-9-11-25(29)19-24)28(20-26)23-14-12-22(21-30)13-15-23/h9-17,19-20H,2-8,18H2,1H3