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

Systemtic Name: 3-(3,4-dichlorophenyl)-1-(3,4-dimethylphenyl)-5-phenyl-pyrazole-4-carboxylic acid Openeye Name: 3-(3,4-dichlorophenyl)-1-(3,4-dimethylphenyl)-5-phenyl-pyrazole-4-carboxylic acid CAS Name: 3-(3,4-dichlorophenyl)-1-(3,4-dimethylphenyl)-5-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 3-(3,4-dichlorophenyl)-1-(3,4-dimethylphenyl)-5-phenylpyrazole-4-carboxylic acid Traditional Name: 3-(3,4-dichlorophenyl)-1-(3,4-dimethylphenyl)-5-phenyl-pyrazole-4-carboxylic acid Formula: C24H18Cl2N2O2 MolecularWeight: 437.31792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C(=N2)C3=CC(=C(C=C3)Cl)Cl)C(=O)O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C(C(=N2)C3=CC(=C(C=C3)Cl)Cl)C(=O)O)C4=CC=CC=C4)C

InChI

InChI=1S/C24H18Cl2N2O2/c1-14-8-10-18(12-15(14)2)28-23(16-6-4-3-5-7-16)21(24(29)30)22(27-28)17-9-11-19(25)20(26)13-17/h3-13H,1-2H3,(H,29,30)