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

Systemtic Name: 2-[2,3-bis(fluoranyl)-4-octoxy-phenyl]-5-octyl-pyrimidine Openeye Name: 2-(2,3-difluoro-4-octoxy-phenyl)-5-octyl-pyrimidine CAS Name: 2-(2,3-difluoro-4-octoxyphenyl)-5-octylpyrimidine IUPAC Name: 2-(2,3-difluoro-4-octoxyphenyl)-5-octylpyrimidine Traditional Name: 2-(2,3-difluoro-4-octoxy-phenyl)-5-octyl-pyrimidine Formula: C26H38F2N2O MolecularWeight: 432.589526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=C(C(=C(C=C2)OCCCCCCCC)F)F

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=C(C(=C(C=C2)OCCCCCCCC)F)F

InChI

InChI=1S/C26H38F2N2O/c1-3-5-7-9-11-13-15-21-19-29-26(30-20-21)22-16-17-23(25(28)24(22)27)31-18-14-12-10-8-6-4-2/h16-17,19-20H,3-15,18H2,1-2H3