3-(4-bromophenyl)-1,5-diphenyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-(4-bromophenyl)-1,5-diphenyl-pyrazole-4-carboxylic acid Openeye Name: 3-(4-bromophenyl)-1,5-diphenyl-pyrazole-4-carboxylic acid CAS Name: 3-(4-bromophenyl)-1,5-diphenyl-4-pyrazolecarboxylic acid IUPAC Name: 3-(4-bromophenyl)-1,5-diphenylpyrazole-4-carboxylic acid Traditional Name: 3-(4-bromophenyl)-1,5-diphenyl-pyrazole-4-carboxylic acid Formula: C22H15BrN2O2 MolecularWeight: 419.2707

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NN2C3=CC=CC=C3)C4=CC=C(C=C4)Br)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NN2C3=CC=CC=C3)C4=CC=C(C=C4)Br)C(=O)O

InChI

InChI=1S/C22H15BrN2O2/c23-17-13-11-15(12-14-17)20-19(22(26)27)21(16-7-3-1-4-8-16)25(24-20)18-9-5-2-6-10-18/h1-14H,(H,26,27)