5-[2,4-bis(fluoranyl)hexoxy]-2-(4-octylphenyl)pyrimidine

Systemtic Name: 5-[2,4-bis(fluoranyl)hexoxy]-2-(4-octylphenyl)pyrimidine Openeye Name: 5-(2,4-difluorohexoxy)-2-(4-octylphenyl)pyrimidine CAS Name: 5-(2,4-difluorohexoxy)-2-(4-octylphenyl)pyrimidine IUPAC Name: 5-(2,4-difluorohexoxy)-2-(4-octylphenyl)pyrimidine Traditional Name: 5-(2,4-difluorohexoxy)-2-(4-octylphenyl)pyrimidine Formula: C24H34F2N2O MolecularWeight: 404.536366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCC(CC(CC)F)F

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCC(CC(CC)F)F

InChI

InChI=1S/C24H34F2N2O/c1-3-5-6-7-8-9-10-19-11-13-20(14-12-19)24-27-16-23(17-28-24)29-18-22(26)15-21(25)4-2/h11-14,16-17,21-22H,3-10,15,18H2,1-2H3