5-(4-bromophenyl)-1-(2,4-dichlorophenyl)pyrazole-3-carboxylic acid

Systemtic Name: 5-(4-bromophenyl)-1-(2,4-dichlorophenyl)pyrazole-3-carboxylic acid Openeye Name: 5-(4-bromophenyl)-1-(2,4-dichlorophenyl)pyrazole-3-carboxylic acid CAS Name: 5-(4-bromophenyl)-1-(2,4-dichlorophenyl)-3-pyrazolecarboxylic acid IUPAC Name: 5-(4-bromophenyl)-1-(2,4-dichlorophenyl)pyrazole-3-carboxylic acid Traditional Name: 5-(4-bromophenyl)-1-(2,4-dichlorophenyl)pyrazole-3-carboxylic acid Formula: C16H9BrCl2N2O2 MolecularWeight: 412.06486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=NN2C3=C(C=C(C=C3)Cl)Cl)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=NN2C3=C(C=C(C=C3)Cl)Cl)C(=O)O)Br

InChI

InChI=1S/C16H9BrCl2N2O2/c17-10-3-1-9(2-4-10)15-8-13(16(22)23)20-21(15)14-6-5-11(18)7-12(14)19/h1-8H,(H,22,23)