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

Systemtic Name: 3-[1-(4-methoxyphenyl)-4-methyl-5-(4-methylphenyl)pyrazol-3-yl]propanoic acid Openeye Name: 3-[1-(4-methoxyphenyl)-4-methyl-5-(p-tolyl)pyrazol-3-yl]propanoic acid CAS Name: 3-[1-(4-methoxyphenyl)-4-methyl-5-(4-methylphenyl)-3-pyrazolyl]propanoic acid IUPAC Name: 3-[1-(4-methoxyphenyl)-4-methyl-5-(4-methylphenyl)pyrazol-3-yl]propanoic acid Traditional Name: 3-[1-(4-methoxyphenyl)-4-methyl-5-(p-tolyl)pyrazol-3-yl]propionic acid Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NN2C3=CC=C(C=C3)OC)CCC(=O)O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NN2C3=CC=C(C=C3)OC)CCC(=O)O)C

InChI

InChI=1S/C21H22N2O3/c1-14-4-6-16(7-5-14)21-15(2)19(12-13-20(24)25)22-23(21)17-8-10-18(26-3)11-9-17/h4-11H,12-13H2,1-3H3,(H,24,25)