4-bromanyl-2-fluoranyl-1-[2-[1-pentyl-4-(4-pentylcyclohexyl)cyclohexyl]ethynyl]benzene

Systemtic Name: 4-bromanyl-2-fluoranyl-1-[2-[1-pentyl-4-(4-pentylcyclohexyl)cyclohexyl]ethynyl]benzene Openeye Name: 4-bromo-2-fluoro-1-[2-[1-pentyl-4-(4-pentylcyclohexyl)cyclohexyl]ethynyl]benzene CAS Name: 4-bromo-2-fluoro-1-[2-[1-pentyl-4-(4-pentylcyclohexyl)cyclohexyl]ethynyl]benzene IUPAC Name: 4-bromo-2-fluoro-1-[2-[1-pentyl-4-(4-pentylcyclohexyl)cyclohexyl]ethynyl]benzene Traditional Name: 1-[2-[1-amyl-4-(4-amylcyclohexyl)cyclohexyl]ethynyl]-4-bromo-2-fluoro-benzene Formula: C30H44BrF MolecularWeight: 503.572763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2CCC(CC2)(CCCCC)C#CC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CCCCCC1CCC(CC1)C2CCC(CC2)(CCCCC)C#CC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C30H44BrF/c1-3-5-7-9-24-10-12-25(13-11-24)26-16-20-30(21-17-26,19-8-6-4-2)22-18-27-14-15-28(31)23-29(27)32/h14-15,23-26H,3-13,16-17,19-21H2,1-2H3