2-[2,3-bis(fluoranyl)-4-[(E)-non-1-enyl]phenyl]-5-nonyl-pyrimidine

Systemtic Name: 2-[2,3-bis(fluoranyl)-4-[(E)-non-1-enyl]phenyl]-5-nonyl-pyrimidine Openeye Name: 2-[2,3-difluoro-4-[(E)-non-1-enyl]phenyl]-5-nonyl-pyrimidine CAS Name: 2-[2,3-difluoro-4-[(E)-non-1-enyl]phenyl]-5-nonylpyrimidine IUPAC Name: 2-[2,3-difluoro-4-[(E)-non-1-enyl]phenyl]-5-nonylpyrimidine Traditional Name: 2-[2,3-difluoro-4-[(E)-non-1-enyl]phenyl]-5-nonyl-pyrimidine Formula: C28H40F2N2 MolecularWeight: 442.627406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCCCC1=CN=C(N=C1)C2=C(C(=C(C=C2)/C=C/CCCCCCC)F)F

InChI

InChI=1S/C28H40F2N2/c1-3-5-7-9-11-13-15-17-23-21-31-28(32-22-23)25-20-19-24(26(29)27(25)30)18-16-14-12-10-8-6-4-2/h16,18-22H,3-15,17H2,1-2H3/b18-16+