4-[2-(4-ethoxy-2-fluoranyl-phenyl)phenyl]-1-pentyl-bicyclo[2.2.2]octane

Systemtic Name: 4-[2-(4-ethoxy-2-fluoranyl-phenyl)phenyl]-1-pentyl-bicyclo[2.2.2]octane Openeye Name: 4-[2-(4-ethoxy-2-fluoro-phenyl)phenyl]-1-pentyl-bicyclo[2.2.2]octane CAS Name: 4-[2-(4-ethoxy-2-fluorophenyl)phenyl]-1-pentylbicyclo[2.2.2]octane IUPAC Name: 4-[2-(4-ethoxy-2-fluorophenyl)phenyl]-1-pentylbicyclo[2.2.2]octane Traditional Name: 1-amyl-4-[2-(4-ethoxy-2-fluoro-phenyl)phenyl]bicyclo[2.2.2]octane Formula: C27H35FO MolecularWeight: 394.564603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC12CCC(CC1)(CC2)C3=CC=CC=C3C4=C(C=C(C=C4)OCC)F

Isomeric SMILES

CCCCCC12CCC(CC1)(CC2)C3=CC=CC=C3C4=C(C=C(C=C4)OCC)F

InChI

InChI=1S/C27H35FO/c1-3-5-8-13-26-14-17-27(18-15-26,19-16-26)24-10-7-6-9-22(24)23-12-11-21(29-4-2)20-25(23)28/h6-7,9-12,20H,3-5,8,13-19H2,1-2H3