[4-(5-propylpyrimidin-2-yl)phenyl] 4-butoxy-2-fluoranyl-benzoate

Systemtic Name: [4-(5-propylpyrimidin-2-yl)phenyl] 4-butoxy-2-fluoranyl-benzoate Openeye Name: [4-(5-propylpyrimidin-2-yl)phenyl] 4-butoxy-2-fluoro-benzoate CAS Name: 4-butoxy-2-fluorobenzoic acid [4-(5-propyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-propylpyrimidin-2-yl)phenyl] 4-butoxy-2-fluorobenzoate Traditional Name: 4-butoxy-2-fluoro-benzoic acid [4-(5-propylpyrimidin-2-yl)phenyl] ester Formula: C24H25FN2O3 MolecularWeight: 408.465303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=NC=C(C=N3)CCC)F

Isomeric SMILES

CCCCOC1=CC(=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=NC=C(C=N3)CCC)F

InChI

InChI=1S/C24H25FN2O3/c1-3-5-13-29-20-11-12-21(22(25)14-20)24(28)30-19-9-7-18(8-10-19)23-26-15-17(6-4-2)16-27-23/h7-12,14-16H,3-6,13H2,1-2H3