5-[4-(2-fluoranyl-4-methyl-pentoxy)phenyl]-2-(4-octoxyphenyl)pyrimidine

Systemtic Name: 5-[4-(2-fluoranyl-4-methyl-pentoxy)phenyl]-2-(4-octoxyphenyl)pyrimidine Openeye Name: 5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]-2-(4-octoxyphenyl)pyrimidine CAS Name: 5-[4-(2-fluoro-4-methylpentoxy)phenyl]-2-(4-octoxyphenyl)pyrimidine IUPAC Name: 5-[4-(2-fluoro-4-methylpentoxy)phenyl]-2-(4-octoxyphenyl)pyrimidine Traditional Name: 5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]-2-(4-octoxyphenyl)pyrimidine Formula: C30H39FN2O2 MolecularWeight: 478.641263

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC(C)C)F

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC(C)C)F

InChI

InChI=1S/C30H39FN2O2/c1-4-5-6-7-8-9-18-34-28-16-12-25(13-17-28)30-32-20-26(21-33-30)24-10-14-29(15-11-24)35-22-27(31)19-23(2)3/h10-17,20-21,23,27H,4-9,18-19,22H2,1-3H3