3-[5-(4-acetamidophenyl)-1-(4-methylphenyl)pyrazol-3-yl]-2-(3-methylphenyl)propanoic acid

Systemtic Name: 3-[5-(4-acetamidophenyl)-1-(4-methylphenyl)pyrazol-3-yl]-2-(3-methylphenyl)propanoic acid Openeye Name: 3-[5-(4-acetamidophenyl)-1-(p-tolyl)pyrazol-3-yl]-2-(m-tolyl)propanoic acid CAS Name: 3-[5-(4-acetamidophenyl)-1-(4-methylphenyl)-3-pyrazolyl]-2-(3-methylphenyl)propanoic acid IUPAC Name: 3-[5-(4-acetamidophenyl)-1-(4-methylphenyl)pyrazol-3-yl]-2-(3-methylphenyl)propanoic acid Traditional Name: 3-[5-(4-acetamidophenyl)-1-(p-tolyl)pyrazol-3-yl]-2-(m-tolyl)propionic acid Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)CC(C3=CC=CC(=C3)C)C(=O)O)C4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)CC(C3=CC=CC(=C3)C)C(=O)O)C4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C28H27N3O3/c1-18-7-13-25(14-8-18)31-27(21-9-11-23(12-10-21)29-20(3)32)17-24(30-31)16-26(28(33)34)22-6-4-5-19(2)15-22/h4-15,17,26H,16H2,1-3H3,(H,29,32)(H,33,34)