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

Systemtic Name: 1-(3-bromophenyl)-3-(4-methylphenyl)-5-phenyl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-bromophenyl)-5-phenyl-3-(p-tolyl)pyrazole-4-carboxylic acid CAS Name: 1-(3-bromophenyl)-3-(4-methylphenyl)-5-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-bromophenyl)-3-(4-methylphenyl)-5-phenylpyrazole-4-carboxylic acid Traditional Name: 1-(3-bromophenyl)-5-phenyl-3-(p-tolyl)pyrazole-4-carboxylic acid Formula: C23H17BrN2O2 MolecularWeight: 433.29728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=C2C(=O)O)C3=CC=CC=C3)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=C2C(=O)O)C3=CC=CC=C3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C23H17BrN2O2/c1-15-10-12-16(13-11-15)21-20(23(27)28)22(17-6-3-2-4-7-17)26(25-21)19-9-5-8-18(24)14-19/h2-14H,1H3,(H,27,28)