3-[5-(2-methoxyphenoxy)-1-(4-methoxyphenyl)-3-methyl-pyrazol-4-yl]propanoic acid

Systemtic Name: 3-[5-(2-methoxyphenoxy)-1-(4-methoxyphenyl)-3-methyl-pyrazol-4-yl]propanoic acid Openeye Name: 3-[5-(2-methoxyphenoxy)-1-(4-methoxyphenyl)-3-methyl-pyrazol-4-yl]propanoic acid CAS Name: 3-[5-(2-methoxyphenoxy)-1-(4-methoxyphenyl)-3-methyl-4-pyrazolyl]propanoic acid IUPAC Name: 3-[5-(2-methoxyphenoxy)-1-(4-methoxyphenyl)-3-methylpyrazol-4-yl]propanoic acid Traditional Name: 3-[5-(2-methoxyphenoxy)-1-(4-methoxyphenyl)-3-methyl-pyrazol-4-yl]propionic acid Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CCC(=O)O)OC2=CC=CC=C2OC)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=NN(C(=C1CCC(=O)O)OC2=CC=CC=C2OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N2O5/c1-14-17(12-13-20(24)25)21(28-19-7-5-4-6-18(19)27-3)23(22-14)15-8-10-16(26-2)11-9-15/h4-11H,12-13H2,1-3H3,(H,24,25)