5-[2,5-bis(fluoranyl)decoxy]-2-(4-dodecylphenyl)pyrimidine

Systemtic Name: 5-[2,5-bis(fluoranyl)decoxy]-2-(4-dodecylphenyl)pyrimidine Openeye Name: 5-(2,5-difluorodecoxy)-2-(4-dodecylphenyl)pyrimidine CAS Name: 5-(2,5-difluorodecoxy)-2-(4-dodecylphenyl)pyrimidine IUPAC Name: 5-(2,5-difluorodecoxy)-2-(4-dodecylphenyl)pyrimidine Traditional Name: 5-(2,5-difluorodecoxy)-2-(4-laurylphenyl)pyrimidine Formula: C32H50F2N2O MolecularWeight: 516.749006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCC(CCC(CCCCC)F)F

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCC(CCC(CCCCC)F)F

InChI

InChI=1S/C32H50F2N2O/c1-3-5-7-8-9-10-11-12-13-15-16-27-18-20-28(21-19-27)32-35-24-31(25-36-32)37-26-30(34)23-22-29(33)17-14-6-4-2/h18-21,24-25,29-30H,3-17,22-23,26H2,1-2H3