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

Systemtic Name: 3-[5-(4-bromophenyl)-1-(4-methylphenyl)pyrazol-3-yl]-2-(3-methylphenyl)propanoic acid Openeye Name: 3-[5-(4-bromophenyl)-1-(p-tolyl)pyrazol-3-yl]-2-(m-tolyl)propanoic acid CAS Name: 3-[5-(4-bromophenyl)-1-(4-methylphenyl)-3-pyrazolyl]-2-(3-methylphenyl)propanoic acid IUPAC Name: 3-[5-(4-bromophenyl)-1-(4-methylphenyl)pyrazol-3-yl]-2-(3-methylphenyl)propanoic acid Traditional Name: 3-[5-(4-bromophenyl)-1-(p-tolyl)pyrazol-3-yl]-2-(m-tolyl)propionic acid Formula: C26H23BrN2O2 MolecularWeight: 475.37702

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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)Br

Isomeric SMILES

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

InChI

InChI=1S/C26H23BrN2O2/c1-17-6-12-23(13-7-17)29-25(19-8-10-21(27)11-9-19)16-22(28-29)15-24(26(30)31)20-5-3-4-18(2)14-20/h3-14,16,24H,15H2,1-2H3,(H,30,31)