2-[3-fluoranyl-4-(3-fluoranylbutoxy)phenyl]-5-heptyl-pyrimidine

Systemtic Name: 2-[3-fluoranyl-4-(3-fluoranylbutoxy)phenyl]-5-heptyl-pyrimidine Openeye Name: 2-[3-fluoro-4-(3-fluorobutoxy)phenyl]-5-heptyl-pyrimidine CAS Name: 2-[3-fluoro-4-(3-fluorobutoxy)phenyl]-5-heptylpyrimidine IUPAC Name: 2-[3-fluoro-4-(3-fluorobutoxy)phenyl]-5-heptylpyrimidine Traditional Name: 2-[3-fluoro-4-(3-fluorobutoxy)phenyl]-5-heptyl-pyrimidine Formula: C21H28F2N2O MolecularWeight: 362.456626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)OCCC(C)F)F

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)OCCC(C)F)F

InChI

InChI=1S/C21H28F2N2O/c1-3-4-5-6-7-8-17-14-24-21(25-15-17)18-9-10-20(19(23)13-18)26-12-11-16(2)22/h9-10,13-16H,3-8,11-12H2,1-2H3