2-[2,3-bis(fluoranyl)-4-octoxy-phenyl]-5-decyl-pyrimidine

Systemtic Name: 2-[2,3-bis(fluoranyl)-4-octoxy-phenyl]-5-decyl-pyrimidine Openeye Name: 5-decyl-2-(2,3-difluoro-4-octoxy-phenyl)pyrimidine CAS Name: 5-decyl-2-(2,3-difluoro-4-octoxyphenyl)pyrimidine IUPAC Name: 5-decyl-2-(2,3-difluoro-4-octoxyphenyl)pyrimidine Traditional Name: 5-decyl-2-(2,3-difluoro-4-octoxy-phenyl)pyrimidine Formula: C28H42F2N2O MolecularWeight: 460.642686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=C(C(=C(C=C2)OCCCCCCCC)F)F

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=C(C(=C(C=C2)OCCCCCCCC)F)F

InChI

InChI=1S/C28H42F2N2O/c1-3-5-7-9-11-12-13-15-17-23-21-31-28(32-22-23)24-18-19-25(27(30)26(24)29)33-20-16-14-10-8-6-4-2/h18-19,21-22H,3-17,20H2,1-2H3