2-fluoranyl-4-[2-[4-(4-pentylphenyl)cyclohexen-1-yl]ethynyl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-4-[2-[4-(4-pentylphenyl)cyclohexen-1-yl]ethynyl]benzenecarbonitrile Openeye Name: 2-fluoro-4-[2-[4-(4-pentylphenyl)cyclohexen-1-yl]ethynyl]benzonitrile CAS Name: 2-fluoro-4-[2-[4-(4-pentylphenyl)-1-cyclohexenyl]ethynyl]benzonitrile IUPAC Name: 2-fluoro-4-[2-[4-(4-pentylphenyl)cyclohexen-1-yl]ethynyl]benzonitrile Traditional Name: 4-[2-[4-(4-amylphenyl)cyclohexen-1-yl]ethynyl]-2-fluoro-benzonitrile Formula: C26H26FN MolecularWeight: 371.489743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2CCC(=CC2)C#CC3=CC(=C(C=C3)C#N)F

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2CCC(=CC2)C#CC3=CC(=C(C=C3)C#N)F

InChI

InChI=1S/C26H26FN/c1-2-3-4-5-20-8-13-23(14-9-20)24-15-10-21(11-16-24)6-7-22-12-17-25(19-28)26(27)18-22/h8-10,12-14,17-18,24H,2-5,11,15-16H2,1H3