4-[2-(6-dodecoxypyridin-3-yl)pyrimidin-5-yl]-2,3-bis(fluoranyl)phenol

Systemtic Name: 4-[2-(6-dodecoxypyridin-3-yl)pyrimidin-5-yl]-2,3-bis(fluoranyl)phenol Openeye Name: 4-[2-(6-dodecoxy-3-pyridyl)pyrimidin-5-yl]-2,3-difluoro-phenol CAS Name: 4-[2-(6-dodecoxy-3-pyridinyl)-5-pyrimidinyl]-2,3-difluorophenol IUPAC Name: 4-[2-(6-dodecoxypyridin-3-yl)pyrimidin-5-yl]-2,3-difluorophenol Traditional Name: 2,3-difluoro-4-[2-(6-lauryloxy-3-pyridyl)pyrimidin-5-yl]phenol Formula: C27H33F2N3O2 MolecularWeight: 469.566626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=NC=C(C=C1)C2=NC=C(C=N2)C3=C(C(=C(C=C3)O)F)F

Isomeric SMILES

CCCCCCCCCCCCOC1=NC=C(C=C1)C2=NC=C(C=N2)C3=C(C(=C(C=C3)O)F)F

InChI

InChI=1S/C27H33F2N3O2/c1-2-3-4-5-6-7-8-9-10-11-16-34-24-15-12-20(17-30-24)27-31-18-21(19-32-27)22-13-14-23(33)26(29)25(22)28/h12-15,17-19,33H,2-11,16H2,1H3