5-(4-bromophenyl)-2-(2-methylphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 5-(4-bromophenyl)-2-(2-methylphenyl)pyrazole-3-carboxylic acid Openeye Name: 5-(4-bromophenyl)-2-(o-tolyl)pyrazole-3-carboxylic acid CAS Name: 5-(4-bromophenyl)-2-(2-methylphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 5-(4-bromophenyl)-2-(2-methylphenyl)pyrazole-3-carboxylic acid Traditional Name: 5-(4-bromophenyl)-2-(o-tolyl)pyrazole-3-carboxylic acid Formula: C17H13BrN2O2 MolecularWeight: 357.20132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=N2)C3=CC=C(C=C3)Br)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=N2)C3=CC=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C17H13BrN2O2/c1-11-4-2-3-5-15(11)20-16(17(21)22)10-14(19-20)12-6-8-13(18)9-7-12/h2-10H,1H3,(H,21,22)