2-but-1-ynyl-3-fluoranyl-1-(4-pentylcyclohexyl)-4-(2-phenylethynyl)benzene

Systemtic Name: 2-but-1-ynyl-3-fluoranyl-1-(4-pentylcyclohexyl)-4-(2-phenylethynyl)benzene Openeye Name: 2-but-1-ynyl-3-fluoro-1-(4-pentylcyclohexyl)-4-(2-phenylethynyl)benzene CAS Name: 2-but-1-ynyl-3-fluoro-1-(4-pentylcyclohexyl)-4-(2-phenylethynyl)benzene IUPAC Name: 2-but-1-ynyl-3-fluoro-1-(4-pentylcyclohexyl)-4-(2-phenylethynyl)benzene Traditional Name: 1-(4-amylcyclohexyl)-2-but-1-ynyl-3-fluoro-4-(2-phenylethynyl)benzene Formula: C29H33F MolecularWeight: 400.570723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=C(C(=C(C=C2)C#CC3=CC=CC=C3)F)C#CCC

Isomeric SMILES

CCCCCC1CCC(CC1)C2=C(C(=C(C=C2)C#CC3=CC=CC=C3)F)C#CCC

InChI

InChI=1S/C29H33F/c1-3-5-8-11-24-15-18-25(19-16-24)27-22-21-26(29(30)28(27)14-6-4-2)20-17-23-12-9-7-10-13-23/h7,9-10,12-13,21-22,24-25H,3-5,8,11,15-16,18-19H2,1-2H3