5-(4-cyclopropylphenyl)-1-(2,4-dichlorophenyl)-4-ethyl-pyrazole-3-carboxylic acid

Systemtic Name: 5-(4-cyclopropylphenyl)-1-(2,4-dichlorophenyl)-4-ethyl-pyrazole-3-carboxylic acid Openeye Name: 5-(4-cyclopropylphenyl)-1-(2,4-dichlorophenyl)-4-ethyl-pyrazole-3-carboxylic acid CAS Name: 5-(4-cyclopropylphenyl)-1-(2,4-dichlorophenyl)-4-ethyl-3-pyrazolecarboxylic acid IUPAC Name: 5-(4-cyclopropylphenyl)-1-(2,4-dichlorophenyl)-4-ethylpyrazole-3-carboxylic acid Traditional Name: 5-(4-cyclopropylphenyl)-1-(2,4-dichlorophenyl)-4-ethyl-pyrazole-3-carboxylic acid Formula: C21H18Cl2N2O2 MolecularWeight: 401.28582

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(N=C1C(=O)O)C2=C(C=C(C=C2)Cl)Cl)C3=CC=C(C=C3)C4CC4

Isomeric SMILES

CCC1=C(N(N=C1C(=O)O)C2=C(C=C(C=C2)Cl)Cl)C3=CC=C(C=C3)C4CC4

InChI

InChI=1S/C21H18Cl2N2O2/c1-2-16-19(21(26)27)24-25(18-10-9-15(22)11-17(18)23)20(16)14-7-5-13(6-8-14)12-3-4-12/h5-12H,2-4H2,1H3,(H,26,27)