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

Systemtic Name: 2-(1-benzofuran-3-yl)-3-[1,5-bis(4-methoxyphenyl)pyrazol-3-yl]propanoic acid Openeye Name: 2-(benzofuran-3-yl)-3-[1,5-bis(4-methoxyphenyl)pyrazol-3-yl]propanoic acid CAS Name: 2-(3-benzofuranyl)-3-[1,5-bis(4-methoxyphenyl)-3-pyrazolyl]propanoic acid IUPAC Name: 2-(1-benzofuran-3-yl)-3-[1,5-bis(4-methoxyphenyl)pyrazol-3-yl]propanoic acid Traditional Name: 2-(benzofuran-3-yl)-3-[1,5-bis(4-methoxyphenyl)pyrazol-3-yl]propionic acid Formula: C28H24N2O5 MolecularWeight: 468.50056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)OC)CC(C4=COC5=CC=CC=C54)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)OC)CC(C4=COC5=CC=CC=C54)C(=O)O

InChI

InChI=1S/C28H24N2O5/c1-33-21-11-7-18(8-12-21)26-16-19(29-30(26)20-9-13-22(34-2)14-10-20)15-24(28(31)32)25-17-35-27-6-4-3-5-23(25)27/h3-14,16-17,24H,15H2,1-2H3,(H,31,32)