4-(bromomethyl)-1-(2-chlorophenyl)-5-(4-chlorophenyl)pyrazole-3-carboxylic acid

Systemtic Name: 4-(bromomethyl)-1-(2-chlorophenyl)-5-(4-chlorophenyl)pyrazole-3-carboxylic acid Openeye Name: 4-(bromomethyl)-1-(2-chlorophenyl)-5-(4-chlorophenyl)pyrazole-3-carboxylic acid CAS Name: 4-(bromomethyl)-1-(2-chlorophenyl)-5-(4-chlorophenyl)-3-pyrazolecarboxylic acid IUPAC Name: 4-(bromomethyl)-1-(2-chlorophenyl)-5-(4-chlorophenyl)pyrazole-3-carboxylic acid Traditional Name: 4-(bromomethyl)-1-(2-chlorophenyl)-5-(4-chlorophenyl)pyrazole-3-carboxylic acid Formula: C17H11BrCl2N2O2 MolecularWeight: 426.09144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N2C(=C(C(=N2)C(=O)O)CBr)C3=CC=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C(C(=C1)N2C(=C(C(=N2)C(=O)O)CBr)C3=CC=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H11BrCl2N2O2/c18-9-12-15(17(23)24)21-22(14-4-2-1-3-13(14)20)16(12)10-5-7-11(19)8-6-10/h1-8H,9H2,(H,23,24)