3-(4-bromophenyl)-1-(4-chlorophenyl)-5-ethyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-(4-bromophenyl)-1-(4-chlorophenyl)-5-ethyl-pyrazole-4-carboxylic acid Openeye Name: 3-(4-bromophenyl)-1-(4-chlorophenyl)-5-ethyl-pyrazole-4-carboxylic acid CAS Name: 3-(4-bromophenyl)-1-(4-chlorophenyl)-5-ethyl-4-pyrazolecarboxylic acid IUPAC Name: 3-(4-bromophenyl)-1-(4-chlorophenyl)-5-ethylpyrazole-4-carboxylic acid Traditional Name: 3-(4-bromophenyl)-1-(4-chlorophenyl)-5-ethyl-pyrazole-4-carboxylic acid Formula: C18H14BrClN2O2 MolecularWeight: 405.67296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Br)C(=O)O

Isomeric SMILES

CCC1=C(C(=NN1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C18H14BrClN2O2/c1-2-15-16(18(23)24)17(11-3-5-12(19)6-4-11)21-22(15)14-9-7-13(20)8-10-14/h3-10H,2H2,1H3,(H,23,24)