3-[1-(3-chlorophenyl)-3-methyl-5-(3-methylphenoxy)pyrazol-4-yl]propanoic acid

Systemtic Name: 3-[1-(3-chlorophenyl)-3-methyl-5-(3-methylphenoxy)pyrazol-4-yl]propanoic acid Openeye Name: 3-[1-(3-chlorophenyl)-3-methyl-5-(3-methylphenoxy)pyrazol-4-yl]propanoic acid CAS Name: 3-[1-(3-chlorophenyl)-3-methyl-5-(3-methylphenoxy)-4-pyrazolyl]propanoic acid IUPAC Name: 3-[1-(3-chlorophenyl)-3-methyl-5-(3-methylphenoxy)pyrazol-4-yl]propanoic acid Traditional Name: 3-[1-(3-chlorophenyl)-3-methyl-5-(3-methylphenoxy)pyrazol-4-yl]propionic acid Formula: C20H19ClN2O3 MolecularWeight: 370.82946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=C(C(=NN2C3=CC(=CC=C3)Cl)C)CCC(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)OC2=C(C(=NN2C3=CC(=CC=C3)Cl)C)CCC(=O)O

InChI

InChI=1S/C20H19ClN2O3/c1-13-5-3-8-17(11-13)26-20-18(9-10-19(24)25)14(2)22-23(20)16-7-4-6-15(21)12-16/h3-8,11-12H,9-10H2,1-2H3,(H,24,25)