3-[5-(4-fluoranylphenoxy)-1-(4-methoxyphenyl)-3-methyl-pyrazol-4-yl]propanoic acid

Systemtic Name: 3-[5-(4-fluoranylphenoxy)-1-(4-methoxyphenyl)-3-methyl-pyrazol-4-yl]propanoic acid Openeye Name: 3-[5-(4-fluorophenoxy)-1-(4-methoxyphenyl)-3-methyl-pyrazol-4-yl]propanoic acid CAS Name: 3-[5-(4-fluorophenoxy)-1-(4-methoxyphenyl)-3-methyl-4-pyrazolyl]propanoic acid IUPAC Name: 3-[5-(4-fluorophenoxy)-1-(4-methoxyphenyl)-3-methylpyrazol-4-yl]propanoic acid Traditional Name: 3-[5-(4-fluorophenoxy)-1-(4-methoxyphenyl)-3-methyl-pyrazol-4-yl]propionic acid Formula: C20H19FN2O4 MolecularWeight: 370.374263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CCC(=O)O)OC2=CC=C(C=C2)F)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=NN(C(=C1CCC(=O)O)OC2=CC=C(C=C2)F)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H19FN2O4/c1-13-18(11-12-19(24)25)20(27-17-7-3-14(21)4-8-17)23(22-13)15-5-9-16(26-2)10-6-15/h3-10H,11-12H2,1-2H3,(H,24,25)