5-(4-cyclopentylphenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazole-3-carboxylic acid

Systemtic Name: 5-(4-cyclopentylphenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazole-3-carboxylic acid Openeye Name: 5-(4-cyclopentylphenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazole-3-carboxylic acid CAS Name: 5-(4-cyclopentylphenyl)-1-(2,4-dichlorophenyl)-4-methyl-3-pyrazolecarboxylic acid IUPAC Name: 5-(4-cyclopentylphenyl)-1-(2,4-dichlorophenyl)-4-methylpyrazole-3-carboxylic acid Traditional Name: 5-(4-cyclopentylphenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazole-3-carboxylic acid Formula: C22H20Cl2N2O2 MolecularWeight: 415.3124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C(=O)O)C2=C(C=C(C=C2)Cl)Cl)C3=CC=C(C=C3)C4CCCC4

Isomeric SMILES

CC1=C(N(N=C1C(=O)O)C2=C(C=C(C=C2)Cl)Cl)C3=CC=C(C=C3)C4CCCC4

InChI

InChI=1S/C22H20Cl2N2O2/c1-13-20(22(27)28)25-26(19-11-10-17(23)12-18(19)24)21(13)16-8-6-15(7-9-16)14-4-2-3-5-14/h6-12,14H,2-5H2,1H3,(H,27,28)