2-fluoranyl-4-[(E)-4-[4-(4-propylphenyl)cyclohexyl]but-3-en-1-ynyl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-4-[(E)-4-[4-(4-propylphenyl)cyclohexyl]but-3-en-1-ynyl]benzenecarbonitrile Openeye Name: 2-fluoro-4-[(E)-4-[4-(4-propylphenyl)cyclohexyl]but-3-en-1-ynyl]benzonitrile CAS Name: 2-fluoro-4-[(E)-4-[4-(4-propylphenyl)cyclohexyl]but-3-en-1-ynyl]benzonitrile IUPAC Name: 2-fluoro-4-[(E)-4-[4-(4-propylphenyl)cyclohexyl]but-3-en-1-ynyl]benzonitrile Traditional Name: 2-fluoro-4-[(E)-4-[4-(4-propylphenyl)cyclohexyl]but-3-en-1-ynyl]benzonitrile Formula: C26H26FN MolecularWeight: 371.489743

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2CCC(CC2)C=CC#CC3=CC(=C(C=C3)C#N)F

Isomeric SMILES

CCCC1=CC=C(C=C1)C2CCC(CC2)/C=C/C#CC3=CC(=C(C=C3)C#N)F

InChI

InChI=1S/C26H26FN/c1-2-5-20-8-13-23(14-9-20)24-15-10-21(11-16-24)6-3-4-7-22-12-17-25(19-28)26(27)18-22/h3,6,8-9,12-14,17-18,21,24H,2,5,10-11,15-16H2,1H3/b6-3+