3-[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-pyrazol-4-yl]propanoic acid

Systemtic Name: 3-[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-pyrazol-4-yl]propanoic acid Openeye Name: 3-[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-pyrazol-4-yl]propanoic acid CAS Name: 3-[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-4-pyrazolyl]propanoic acid IUPAC Name: 3-[3-ethyl-1-(4-fluorophenyl)-5-phenoxypyrazol-4-yl]propanoic acid Traditional Name: 3-[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-pyrazol-4-yl]propionic acid Formula: C20H19FN2O3 MolecularWeight: 354.374863

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1CCC(=O)O)OC2=CC=CC=C2)C3=CC=C(C=C3)F

Isomeric SMILES

CCC1=NN(C(=C1CCC(=O)O)OC2=CC=CC=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H19FN2O3/c1-2-18-17(12-13-19(24)25)20(26-16-6-4-3-5-7-16)23(22-18)15-10-8-14(21)9-11-15/h3-11H,2,12-13H2,1H3,(H,24,25)