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

Systemtic Name: 1-(3-bromophenyl)-3-(4-chlorophenyl)-5-propyl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-bromophenyl)-3-(4-chlorophenyl)-5-propyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-bromophenyl)-3-(4-chlorophenyl)-5-propyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-bromophenyl)-3-(4-chlorophenyl)-5-propylpyrazole-4-carboxylic acid Traditional Name: 1-(3-bromophenyl)-3-(4-chlorophenyl)-5-propyl-pyrazole-4-carboxylic acid Formula: C19H16BrClN2O2 MolecularWeight: 419.69954

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NN1C2=CC(=CC=C2)Br)C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CCCC1=C(C(=NN1C2=CC(=CC=C2)Br)C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C19H16BrClN2O2/c1-2-4-16-17(19(24)25)18(12-7-9-14(21)10-8-12)22-23(16)15-6-3-5-13(20)11-15/h3,5-11H,2,4H2,1H3,(H,24,25)