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

Systemtic Name: 1-(3-bromophenyl)-3-(3,4-dichlorophenyl)-5-phenyl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-bromophenyl)-3-(3,4-dichlorophenyl)-5-phenyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-bromophenyl)-3-(3,4-dichlorophenyl)-5-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-bromophenyl)-3-(3,4-dichlorophenyl)-5-phenylpyrazole-4-carboxylic acid Traditional Name: 1-(3-bromophenyl)-3-(3,4-dichlorophenyl)-5-phenyl-pyrazole-4-carboxylic acid Formula: C22H13BrCl2N2O2 MolecularWeight: 488.16082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H13BrCl2N2O2/c23-15-7-4-8-16(12-15)27-21(13-5-2-1-3-6-13)19(22(28)29)20(26-27)14-9-10-17(24)18(25)11-14/h1-12H,(H,28,29)