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

Systemtic Name: 3-[5-(3,4-dichlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]-2-phenyl-propanoic acid Openeye Name: 3-[5-(3,4-dichlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]-2-phenyl-propanoic acid CAS Name: 3-[5-(3,4-dichlorophenyl)-1-(4-methoxyphenyl)-3-pyrazolyl]-2-phenylpropanoic acid IUPAC Name: 3-[5-(3,4-dichlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]-2-phenylpropanoic acid Traditional Name: 3-[5-(3,4-dichlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]-2-phenyl-propionic acid Formula: C25H20Cl2N2O3 MolecularWeight: 467.3439

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=CC(=N2)CC(C3=CC=CC=C3)C(=O)O)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=CC(=N2)CC(C3=CC=CC=C3)C(=O)O)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C25H20Cl2N2O3/c1-32-20-10-8-19(9-11-20)29-24(17-7-12-22(26)23(27)13-17)15-18(28-29)14-21(25(30)31)16-5-3-2-4-6-16/h2-13,15,21H,14H2,1H3,(H,30,31)