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

Systemtic Name: 1-(4-chlorophenyl)-3-(3,4-dichlorophenyl)-5-phenyl-pyrazole-4-carboxylic acid Openeye Name: 1-(4-chlorophenyl)-3-(3,4-dichlorophenyl)-5-phenyl-pyrazole-4-carboxylic acid CAS Name: 1-(4-chlorophenyl)-3-(3,4-dichlorophenyl)-5-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-chlorophenyl)-3-(3,4-dichlorophenyl)-5-phenylpyrazole-4-carboxylic acid Traditional Name: 1-(4-chlorophenyl)-3-(3,4-dichlorophenyl)-5-phenyl-pyrazole-4-carboxylic acid Formula: C22H13Cl3N2O2 MolecularWeight: 443.70982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H13Cl3N2O2/c23-15-7-9-16(10-8-15)27-21(13-4-2-1-3-5-13)19(22(28)29)20(26-27)14-6-11-17(24)18(25)12-14/h1-12H,(H,28,29)