2,3-bis(fluoranyl)-1-[2-fluoranyl-4-(4-pentylphenyl)phenyl]-4-octoxy-benzene

Systemtic Name: 2,3-bis(fluoranyl)-1-[2-fluoranyl-4-(4-pentylphenyl)phenyl]-4-octoxy-benzene Openeye Name: 2,3-difluoro-1-[2-fluoro-4-(4-pentylphenyl)phenyl]-4-octoxy-benzene CAS Name: 2,3-difluoro-1-[2-fluoro-4-(4-pentylphenyl)phenyl]-4-octoxybenzene IUPAC Name: 2,3-difluoro-1-[2-fluoro-4-(4-pentylphenyl)phenyl]-4-octoxybenzene Traditional Name: 1-[4-(4-amylphenyl)-2-fluoro-phenyl]-2,3-difluoro-4-octoxy-benzene Formula: C31H37F3O MolecularWeight: 482.62009

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C(=C(C=C1)C2=C(C=C(C=C2)C3=CC=C(C=C3)CCCCC)F)F)F

Isomeric SMILES

CCCCCCCCOC1=C(C(=C(C=C1)C2=C(C=C(C=C2)C3=CC=C(C=C3)CCCCC)F)F)F

InChI

InChI=1S/C31H37F3O/c1-3-5-7-8-9-11-21-35-29-20-19-27(30(33)31(29)34)26-18-17-25(22-28(26)32)24-15-13-23(14-16-24)12-10-6-4-2/h13-20,22H,3-12,21H2,1-2H3