3-[5-[2,4-bis(fluoranyl)phenoxy]-3-ethyl-1-phenyl-pyrazol-4-yl]propanoic acid

Systemtic Name: 3-[5-[2,4-bis(fluoranyl)phenoxy]-3-ethyl-1-phenyl-pyrazol-4-yl]propanoic acid Openeye Name: 3-[5-(2,4-difluorophenoxy)-3-ethyl-1-phenyl-pyrazol-4-yl]propanoic acid CAS Name: 3-[5-(2,4-difluorophenoxy)-3-ethyl-1-phenyl-4-pyrazolyl]propanoic acid IUPAC Name: 3-[5-(2,4-difluorophenoxy)-3-ethyl-1-phenylpyrazol-4-yl]propanoic acid Traditional Name: 3-[5-(2,4-difluorophenoxy)-3-ethyl-1-phenyl-pyrazol-4-yl]propionic acid Formula: C20H18F2N2O3 MolecularWeight: 372.365326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18F2N2O3/c1-2-17-15(9-11-19(25)26)20(24(23-17)14-6-4-3-5-7-14)27-18-10-8-13(21)12-16(18)22/h3-8,10,12H,2,9,11H2,1H3,(H,25,26)