3-[3-(2,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]propanoic acid

Systemtic Name: 3-[3-(2,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]propanoic acid Openeye Name: 3-[3-(2,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]propanoic acid CAS Name: 3-[3-(2,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]propanoic acid IUPAC Name: 3-[3-(2,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]propanoic acid Traditional Name: 3-[3-(2,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]propionic acid Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=NN(C=C2CCC(=O)O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=NN(C=C2CCC(=O)O)C3=CC=CC=C3)OC

InChI

InChI=1S/C20H20N2O4/c1-25-16-9-10-17(18(12-16)26-2)20-14(8-11-19(23)24)13-22(21-20)15-6-4-3-5-7-15/h3-7,9-10,12-13H,8,11H2,1-2H3,(H,23,24)