4-[4-(4-butoxyphenyl)-5,5-bis(fluoranyl)-4-methyl-pentyl]-1-fluoranyl-2-phenoxy-benzene

Systemtic Name: 4-[4-(4-butoxyphenyl)-5,5-bis(fluoranyl)-4-methyl-pentyl]-1-fluoranyl-2-phenoxy-benzene Openeye Name: 4-[4-(4-butoxyphenyl)-5,5-difluoro-4-methyl-pentyl]-1-fluoro-2-phenoxy-benzene CAS Name: 4-[4-(4-butoxyphenyl)-5,5-difluoro-4-methylpentyl]-1-fluoro-2-phenoxybenzene IUPAC Name: 4-[4-(4-butoxyphenyl)-5,5-difluoro-4-methylpentyl]-1-fluoro-2-phenoxybenzene Traditional Name: 4-[4-(4-butoxyphenyl)-5,5-difluoro-4-methyl-pentyl]-1-fluoro-2-phenoxy-benzene Formula: C28H31F3O2 MolecularWeight: 456.53975

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(C)(CCCC2=CC(=C(C=C2)F)OC3=CC=CC=C3)C(F)F

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(C)(CCCC2=CC(=C(C=C2)F)OC3=CC=CC=C3)C(F)F

InChI

InChI=1S/C28H31F3O2/c1-3-4-19-32-23-15-13-22(14-16-23)28(2,27(30)31)18-8-9-21-12-17-25(29)26(20-21)33-24-10-6-5-7-11-24/h5-7,10-17,20,27H,3-4,8-9,18-19H2,1-2H3