2-(1-benzofuran-3-yl)-3-[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]propanoic acid

Systemtic Name: 2-(1-benzofuran-3-yl)-3-[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]propanoic acid Openeye Name: 2-(benzofuran-3-yl)-3-[1-(4-methoxyphenyl)-5-(p-tolyl)pyrazol-3-yl]propanoic acid CAS Name: 2-(3-benzofuranyl)-3-[1-(4-methoxyphenyl)-5-(4-methylphenyl)-3-pyrazolyl]propanoic acid IUPAC Name: 2-(1-benzofuran-3-yl)-3-[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]propanoic acid Traditional Name: 2-(benzofuran-3-yl)-3-[1-(4-methoxyphenyl)-5-(p-tolyl)pyrazol-3-yl]propionic acid Formula: C28H24N2O4 MolecularWeight: 452.50116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)OC)CC(C4=COC5=CC=CC=C54)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)OC)CC(C4=COC5=CC=CC=C54)C(=O)O

InChI

InChI=1S/C28H24N2O4/c1-18-7-9-19(10-8-18)26-16-20(29-30(26)21-11-13-22(33-2)14-12-21)15-24(28(31)32)25-17-34-27-6-4-3-5-23(25)27/h3-14,16-17,24H,15H2,1-2H3,(H,31,32)