1-butyl-4-[4-(4-pentylphenyl)cyclohexyl]bicyclo[2.2.2]octane

Systemtic Name: 1-butyl-4-[4-(4-pentylphenyl)cyclohexyl]bicyclo[2.2.2]octane Openeye Name: 1-butyl-4-[4-(4-pentylphenyl)cyclohexyl]bicyclo[2.2.2]octane CAS Name: 1-butyl-4-[4-(4-pentylphenyl)cyclohexyl]bicyclo[2.2.2]octane IUPAC Name: 1-butyl-4-[4-(4-pentylphenyl)cyclohexyl]bicyclo[2.2.2]octane Traditional Name: 4-[4-(4-amylphenyl)cyclohexyl]-1-butyl-bicyclo[2.2.2]octane Formula: C29H46 MolecularWeight: 394.67554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2CCC(CC2)C34CCC(CC3)(CC4)CCCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2CCC(CC2)C34CCC(CC3)(CC4)CCCC

InChI

InChI=1S/C29H46/c1-3-5-7-8-24-9-11-25(12-10-24)26-13-15-27(16-14-26)29-21-18-28(19-22-29,20-23-29)17-6-4-2/h9-12,26-27H,3-8,13-23H2,1-2H3