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

Systemtic Name: 3-(3,4-dichlorophenyl)-1-(3,4-dimethylphenyl)-5-ethyl-pyrazole-4-carboxylic acid Openeye Name: 3-(3,4-dichlorophenyl)-1-(3,4-dimethylphenyl)-5-ethyl-pyrazole-4-carboxylic acid CAS Name: 3-(3,4-dichlorophenyl)-1-(3,4-dimethylphenyl)-5-ethyl-4-pyrazolecarboxylic acid IUPAC Name: 3-(3,4-dichlorophenyl)-1-(3,4-dimethylphenyl)-5-ethylpyrazole-4-carboxylic acid Traditional Name: 3-(3,4-dichlorophenyl)-1-(3,4-dimethylphenyl)-5-ethyl-pyrazole-4-carboxylic acid Formula: C20H18Cl2N2O2 MolecularWeight: 389.27512

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC(=C(C=C2)C)C)C3=CC(=C(C=C3)Cl)Cl)C(=O)O

Isomeric SMILES

CCC1=C(C(=NN1C2=CC(=C(C=C2)C)C)C3=CC(=C(C=C3)Cl)Cl)C(=O)O

InChI

InChI=1S/C20H18Cl2N2O2/c1-4-17-18(20(25)26)19(13-6-8-15(21)16(22)10-13)23-24(17)14-7-5-11(2)12(3)9-14/h5-10H,4H2,1-3H3,(H,25,26)