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

Systemtic Name: 2-[2,3-bis(fluoranyl)-4-(4-pentylphenyl)phenyl]-5-nonyl-pyrimidine Openeye Name: 2-[2,3-difluoro-4-(4-pentylphenyl)phenyl]-5-nonyl-pyrimidine CAS Name: 2-[2,3-difluoro-4-(4-pentylphenyl)phenyl]-5-nonylpyrimidine IUPAC Name: 2-[2,3-difluoro-4-(4-pentylphenyl)phenyl]-5-nonylpyrimidine Traditional Name: 2-[4-(4-amylphenyl)-2,3-difluoro-phenyl]-5-nonyl-pyrimidine Formula: C30H38F2N2 MolecularWeight: 464.632926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(N=C1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)CCCCC)F)F

Isomeric SMILES

CCCCCCCCCC1=CN=C(N=C1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)CCCCC)F)F

InChI

InChI=1S/C30H38F2N2/c1-3-5-7-8-9-10-12-14-24-21-33-30(34-22-24)27-20-19-26(28(31)29(27)32)25-17-15-23(16-18-25)13-11-6-4-2/h15-22H,3-14H2,1-2H3