1-[(E)-4-(4-butylcyclohexyl)but-3-en-1-ynyl]-2-fluoranyl-4-pentyl-benzene

Systemtic Name: 1-[(E)-4-(4-butylcyclohexyl)but-3-en-1-ynyl]-2-fluoranyl-4-pentyl-benzene Openeye Name: 1-[(E)-4-(4-butylcyclohexyl)but-3-en-1-ynyl]-2-fluoro-4-pentyl-benzene CAS Name: 1-[(E)-4-(4-butylcyclohexyl)but-3-en-1-ynyl]-2-fluoro-4-pentylbenzene IUPAC Name: 1-[(E)-4-(4-butylcyclohexyl)but-3-en-1-ynyl]-2-fluoro-4-pentylbenzene Traditional Name: 4-amyl-1-[(E)-4-(4-butylcyclohexyl)but-3-en-1-ynyl]-2-fluoro-benzene Formula: C25H35F MolecularWeight: 354.543803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)C#CC=CC2CCC(CC2)CCCC)F

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)C#C/C=C/C2CCC(CC2)CCCC)F

InChI

InChI=1S/C25H35F/c1-3-5-7-12-23-18-19-24(25(26)20-23)13-9-8-11-22-16-14-21(15-17-22)10-6-4-2/h8,11,18-22H,3-7,10,12,14-17H2,1-2H3/b11-8+