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

Systemtic Name: 4-[5,5-bis(fluoranyl)-4-methyl-4-(4-propoxyphenyl)pentyl]-1-fluoranyl-2-phenoxy-benzene Openeye Name: 4-[5,5-difluoro-4-methyl-4-(4-propoxyphenyl)pentyl]-1-fluoro-2-phenoxy-benzene CAS Name: 4-[5,5-difluoro-4-methyl-4-(4-propoxyphenyl)pentyl]-1-fluoro-2-phenoxybenzene IUPAC Name: 4-[5,5-difluoro-4-methyl-4-(4-propoxyphenyl)pentyl]-1-fluoro-2-phenoxybenzene Traditional Name: 4-[5,5-difluoro-4-methyl-4-(4-propoxyphenyl)pentyl]-1-fluoro-2-phenoxy-benzene Formula: C27H29F3O2 MolecularWeight: 442.51317

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(C)(CCCC2=CC(=C(C=C2)F)OC3=CC=CC=C3)C(F)F

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(C)(CCCC2=CC(=C(C=C2)F)OC3=CC=CC=C3)C(F)F

InChI

InChI=1S/C27H29F3O2/c1-3-18-31-22-14-12-21(13-15-22)27(2,26(29)30)17-7-8-20-11-16-24(28)25(19-20)32-23-9-5-4-6-10-23/h4-6,9-16,19,26H,3,7-8,17-18H2,1-2H3