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

Systemtic Name: 3-(4-bromophenyl)-1-(4-methylphenyl)-5-propyl-pyrazole-4-carboxylic acid Openeye Name: 3-(4-bromophenyl)-5-propyl-1-(p-tolyl)pyrazole-4-carboxylic acid CAS Name: 3-(4-bromophenyl)-1-(4-methylphenyl)-5-propyl-4-pyrazolecarboxylic acid IUPAC Name: 3-(4-bromophenyl)-1-(4-methylphenyl)-5-propylpyrazole-4-carboxylic acid Traditional Name: 3-(4-bromophenyl)-5-propyl-1-(p-tolyl)pyrazole-4-carboxylic acid Formula: C20H19BrN2O2 MolecularWeight: 399.28106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19BrN2O2/c1-3-4-17-18(20(24)25)19(14-7-9-15(21)10-8-14)22-23(17)16-11-5-13(2)6-12-16/h5-12H,3-4H2,1-2H3,(H,24,25)