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

Systemtic Name: 2-fluoranyl-6-(4-octoxyphenyl)-3-(4-pentylphenyl)benzenecarbonitrile Openeye Name: 2-fluoro-6-(4-octoxyphenyl)-3-(4-pentylphenyl)benzonitrile CAS Name: 2-fluoro-6-(4-octoxyphenyl)-3-(4-pentylphenyl)benzonitrile IUPAC Name: 2-fluoro-6-(4-octoxyphenyl)-3-(4-pentylphenyl)benzonitrile Traditional Name: 3-(4-amylphenyl)-2-fluoro-6-(4-octoxyphenyl)benzonitrile Formula: C32H38FNO MolecularWeight: 471.648623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)CCCCC)F)C#N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)CCCCC)F)C#N

InChI

InChI=1S/C32H38FNO/c1-3-5-7-8-9-11-23-35-28-19-17-26(18-20-28)29-21-22-30(32(33)31(29)24-34)27-15-13-25(14-16-27)12-10-6-4-2/h13-22H,3-12,23H2,1-2H3