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

Systemtic Name: 2,5-bis(4-bromophenyl)pyrazole-3-carboxylic acid Openeye Name: 2,5-bis(4-bromophenyl)pyrazole-3-carboxylic acid CAS Name: 2,5-bis(4-bromophenyl)-3-pyrazolecarboxylic acid IUPAC Name: 2,5-bis(4-bromophenyl)pyrazole-3-carboxylic acid Traditional Name: 2,5-bis(4-bromophenyl)pyrazole-3-carboxylic acid Formula: C16H10Br2N2O2 MolecularWeight: 422.0708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C(=C2)C(=O)O)C3=CC=C(C=C3)Br)Br

Isomeric SMILES

C1=CC(=CC=C1C2=NN(C(=C2)C(=O)O)C3=CC=C(C=C3)Br)Br

InChI

InChI=1S/C16H10Br2N2O2/c17-11-3-1-10(2-4-11)14-9-15(16(21)22)20(19-14)13-7-5-12(18)6-8-13/h1-9H,(H,21,22)