5-[3,7-bis(fluoranyl)decoxy]-2-(4-dodecylphenyl)pyrimidine

Systemtic Name: 5-[3,7-bis(fluoranyl)decoxy]-2-(4-dodecylphenyl)pyrimidine Openeye Name: 5-(3,7-difluorodecoxy)-2-(4-dodecylphenyl)pyrimidine CAS Name: 5-(3,7-difluorodecoxy)-2-(4-dodecylphenyl)pyrimidine IUPAC Name: 5-(3,7-difluorodecoxy)-2-(4-dodecylphenyl)pyrimidine Traditional Name: 5-(3,7-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)OCCC(CCCC(CCC)F)F

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCCC(CCCC(CCC)F)F

InChI

InChI=1S/C32H50F2N2O/c1-3-5-6-7-8-9-10-11-12-13-16-27-19-21-28(22-20-27)32-35-25-31(26-36-32)37-24-23-30(34)18-14-17-29(33)15-4-2/h19-22,25-26,29-30H,3-18,23-24H2,1-2H3