4,6-bis(chloranyl)-2-[4-(2-fluoranyl-4-pentyl-phenyl)phenyl]-5-nonyl-pyrimidine

Systemtic Name: 4,6-bis(chloranyl)-2-[4-(2-fluoranyl-4-pentyl-phenyl)phenyl]-5-nonyl-pyrimidine Openeye Name: 4,6-dichloro-2-[4-(2-fluoro-4-pentyl-phenyl)phenyl]-5-nonyl-pyrimidine CAS Name: 4,6-dichloro-2-[4-(2-fluoro-4-pentylphenyl)phenyl]-5-nonylpyrimidine IUPAC Name: 4,6-dichloro-2-[4-(2-fluoro-4-pentylphenyl)phenyl]-5-nonylpyrimidine Traditional Name: 2-[4-(4-amyl-2-fluoro-phenyl)phenyl]-4,6-dichloro-5-nonyl-pyrimidine Formula: C30H37Cl2FN2 MolecularWeight: 515.532583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(N=C(N=C1Cl)C2=CC=C(C=C2)C3=C(C=C(C=C3)CCCCC)F)Cl

Isomeric SMILES

CCCCCCCCCC1=C(N=C(N=C1Cl)C2=CC=C(C=C2)C3=C(C=C(C=C3)CCCCC)F)Cl

InChI

InChI=1S/C30H37Cl2FN2/c1-3-5-7-8-9-10-12-14-26-28(31)34-30(35-29(26)32)24-18-16-23(17-19-24)25-20-15-22(21-27(25)33)13-11-6-4-2/h15-21H,3-14H2,1-2H3