2-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(4-phenylmethoxyphenyl)propanoic acid

Systemtic Name: 2-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(4-phenylmethoxyphenyl)propanoic acid Openeye Name: 3-(4-benzyloxyphenyl)-2-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]propanoic acid CAS Name: 2-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(4-phenylmethoxyphenyl)propanoic acid IUPAC Name: 2-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-(4-phenylmethoxyphenyl)propanoic acid Traditional Name: 3-(4-benzoxyphenyl)-2-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]propionic acid Formula: C25H21FN2O3 MolecularWeight: 416.444243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C3=C(NN=C3)C4=CC=C(C=C4)F)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C3=C(NN=C3)C4=CC=C(C=C4)F)C(=O)O

InChI

InChI=1S/C25H21FN2O3/c26-20-10-8-19(9-11-20)24-23(15-27-28-24)22(25(29)30)14-17-6-12-21(13-7-17)31-16-18-4-2-1-3-5-18/h1-13,15,22H,14,16H2,(H,27,28)(H,29,30)