4-[2-(4-bromophenyl)ethyl]-1-pentyl-bicyclo[2.2.2]octane

Systemtic Name: 4-[2-(4-bromophenyl)ethyl]-1-pentyl-bicyclo[2.2.2]octane Openeye Name: 4-[2-(4-bromophenyl)ethyl]-1-pentyl-bicyclo[2.2.2]octane CAS Name: 4-[2-(4-bromophenyl)ethyl]-1-pentylbicyclo[2.2.2]octane IUPAC Name: 4-[2-(4-bromophenyl)ethyl]-1-pentylbicyclo[2.2.2]octane Traditional Name: 1-amyl-4-[2-(4-bromophenyl)ethyl]bicyclo[2.2.2]octane Formula: C21H31Br MolecularWeight: 363.37484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC12CCC(CC1)(CC2)CCC3=CC=C(C=C3)Br

Isomeric SMILES

CCCCCC12CCC(CC1)(CC2)CCC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H31Br/c1-2-3-4-10-20-12-15-21(16-13-20,17-14-20)11-9-18-5-7-19(22)8-6-18/h5-8H,2-4,9-17H2,1H3