1,2-bis(fluoranyl)-3-octoxy-3-pentyl-6-(4-phenylphenyl)cyclohexa-1,4-diene

Systemtic Name: 1,2-bis(fluoranyl)-3-octoxy-3-pentyl-6-(4-phenylphenyl)cyclohexa-1,4-diene Openeye Name: 1,2-difluoro-3-octoxy-3-pentyl-6-(4-phenylphenyl)cyclohexa-1,4-diene CAS Name: 1,2-difluoro-3-octoxy-3-pentyl-6-(4-phenylphenyl)cyclohexa-1,4-diene IUPAC Name: 1,2-difluoro-3-octoxy-3-pentyl-6-(4-phenylphenyl)cyclohexa-1,4-diene Traditional Name: 3-amyl-1,2-difluoro-3-octoxy-6-(4-phenylphenyl)cyclohexa-1,4-diene Formula: C31H40F2O MolecularWeight: 466.645506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1(C=CC(C(=C1F)F)C2=CC=C(C=C2)C3=CC=CC=C3)CCCCC

Isomeric SMILES

CCCCCCCCOC1(C=CC(C(=C1F)F)C2=CC=C(C=C2)C3=CC=CC=C3)CCCCC

InChI

InChI=1S/C31H40F2O/c1-3-5-7-8-9-14-24-34-31(22-13-6-4-2)23-21-28(29(32)30(31)33)27-19-17-26(18-20-27)25-15-11-10-12-16-25/h10-12,15-21,23,28H,3-9,13-14,22,24H2,1-2H3