(4-chlorophenyl) 4-(5-butylpyrimidin-2-yl)-2-fluoranyl-benzoate

Systemtic Name: (4-chlorophenyl) 4-(5-butylpyrimidin-2-yl)-2-fluoranyl-benzoate Openeye Name: (4-chlorophenyl) 4-(5-butylpyrimidin-2-yl)-2-fluoro-benzoate CAS Name: 4-(5-butyl-2-pyrimidinyl)-2-fluorobenzoic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) 4-(5-butylpyrimidin-2-yl)-2-fluorobenzoate Traditional Name: 4-(5-butylpyrimidin-2-yl)-2-fluoro-benzoic acid (4-chlorophenyl) ester Formula: C21H18ClFN2O2 MolecularWeight: 384.831223

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)Cl)F

Isomeric SMILES

CCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)Cl)F

InChI

InChI=1S/C21H18ClFN2O2/c1-2-3-4-14-12-24-20(25-13-14)15-5-10-18(19(23)11-15)21(26)27-17-8-6-16(22)7-9-17/h5-13H,2-4H2,1H3