2-[2,3-bis(fluoranyl)-4-hexoxy-phenyl]-5-bromanyl-pyrimidine

Systemtic Name: 2-[2,3-bis(fluoranyl)-4-hexoxy-phenyl]-5-bromanyl-pyrimidine Openeye Name: 5-bromo-2-(2,3-difluoro-4-hexoxy-phenyl)pyrimidine CAS Name: 5-bromo-2-(2,3-difluoro-4-hexoxyphenyl)pyrimidine IUPAC Name: 5-bromo-2-(2,3-difluoro-4-hexoxyphenyl)pyrimidine Traditional Name: 5-bromo-2-(2,3-difluoro-4-hexoxy-phenyl)pyrimidine Formula: C16H17BrF2N2O MolecularWeight: 371.219786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C(=C(C=C1)C2=NC=C(C=N2)Br)F)F

Isomeric SMILES

CCCCCCOC1=C(C(=C(C=C1)C2=NC=C(C=N2)Br)F)F

InChI

InChI=1S/C16H17BrF2N2O/c1-2-3-4-5-8-22-13-7-6-12(14(18)15(13)19)16-20-9-11(17)10-21-16/h6-7,9-10H,2-5,8H2,1H3