2-[2,3-bis(fluoranyl)-4-(6-fluoranylheptyl)phenyl]-5-nonyl-pyrimidine

Systemtic Name: 2-[2,3-bis(fluoranyl)-4-(6-fluoranylheptyl)phenyl]-5-nonyl-pyrimidine Openeye Name: 2-[2,3-difluoro-4-(6-fluoroheptyl)phenyl]-5-nonyl-pyrimidine CAS Name: 2-[2,3-difluoro-4-(6-fluoroheptyl)phenyl]-5-nonylpyrimidine IUPAC Name: 2-[2,3-difluoro-4-(6-fluoroheptyl)phenyl]-5-nonylpyrimidine Traditional Name: 2-[2,3-difluoro-4-(6-fluoroheptyl)phenyl]-5-nonyl-pyrimidine Formula: C26H37F3N2 MolecularWeight: 434.58059

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(N=C1)C2=C(C(=C(C=C2)CCCCCC(C)F)F)F

Isomeric SMILES

CCCCCCCCCC1=CN=C(N=C1)C2=C(C(=C(C=C2)CCCCCC(C)F)F)F

InChI

InChI=1S/C26H37F3N2/c1-3-4-5-6-7-8-11-14-21-18-30-26(31-19-21)23-17-16-22(24(28)25(23)29)15-12-9-10-13-20(2)27/h16-20H,3-15H2,1-2H3