1-butyl-2-fluoranyl-4-[2-[4-(4-heptylphenyl)cyclohexyl]ethynyl]benzene

Systemtic Name: 1-butyl-2-fluoranyl-4-[2-[4-(4-heptylphenyl)cyclohexyl]ethynyl]benzene Openeye Name: 1-butyl-2-fluoro-4-[2-[4-(4-heptylphenyl)cyclohexyl]ethynyl]benzene CAS Name: 1-butyl-2-fluoro-4-[2-[4-(4-heptylphenyl)cyclohexyl]ethynyl]benzene IUPAC Name: 1-butyl-2-fluoro-4-[2-[4-(4-heptylphenyl)cyclohexyl]ethynyl]benzene Traditional Name: 1-butyl-2-fluoro-4-[2-[4-(4-heptylphenyl)cyclohexyl]ethynyl]benzene Formula: C31H41F MolecularWeight: 432.655643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2CCC(CC2)C#CC3=CC(=C(C=C3)CCCC)F

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2CCC(CC2)C#CC3=CC(=C(C=C3)CCCC)F

InChI

InChI=1S/C31H41F/c1-3-5-7-8-9-10-25-14-19-28(20-15-25)29-21-16-26(17-22-29)12-13-27-18-23-30(11-6-4-2)31(32)24-27/h14-15,18-20,23-24,26,29H,3-11,16-17,21-22H2,1-2H3