(4-decylphenyl) 2-fluoranyl-4-(5-nonylpyrimidin-2-yl)benzoate

Systemtic Name: (4-decylphenyl) 2-fluoranyl-4-(5-nonylpyrimidin-2-yl)benzoate Openeye Name: (4-decylphenyl) 2-fluoro-4-(5-nonylpyrimidin-2-yl)benzoate CAS Name: 2-fluoro-4-(5-nonyl-2-pyrimidinyl)benzoic acid (4-decylphenyl) ester IUPAC Name: (4-decylphenyl) 2-fluoro-4-(5-nonylpyrimidin-2-yl)benzoate Traditional Name: 2-fluoro-4-(5-nonylpyrimidin-2-yl)benzoic acid (4-decylphenyl) ester Formula: C36H49FN2O2 MolecularWeight: 560.784863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)C3=NC=C(C=N3)CCCCCCCCC)F

Isomeric SMILES

CCCCCCCCCCC1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)C3=NC=C(C=N3)CCCCCCCCC)F

InChI

InChI=1S/C36H49FN2O2/c1-3-5-7-9-11-13-14-16-18-29-20-23-32(24-21-29)41-36(40)33-25-22-31(26-34(33)37)35-38-27-30(28-39-35)19-17-15-12-10-8-6-4-2/h20-28H,3-19H2,1-2H3