[2-(2,4-dimethylphenyl)-5-propyl-pyrazol-3-yl] 3,5-bis(chloranyl)benzoate

Systemtic Name: [2-(2,4-dimethylphenyl)-5-propyl-pyrazol-3-yl] 3,5-bis(chloranyl)benzoate Openeye Name: [2-(2,4-dimethylphenyl)-5-propyl-pyrazol-3-yl] 3,5-dichlorobenzoate CAS Name: 3,5-dichlorobenzoic acid [2-(2,4-dimethylphenyl)-5-propyl-3-pyrazolyl] ester IUPAC Name: [2-(2,4-dimethylphenyl)-5-propylpyrazol-3-yl] 3,5-dichlorobenzoate Traditional Name: 3,5-dichlorobenzoic acid [2-(2,4-dimethylphenyl)-5-propyl-pyrazol-3-yl] ester Formula: C21H20Cl2N2O2 MolecularWeight: 403.3017

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1)OC(=O)C2=CC(=CC(=C2)Cl)Cl)C3=C(C=C(C=C3)C)C

Isomeric SMILES

CCCC1=NN(C(=C1)OC(=O)C2=CC(=CC(=C2)Cl)Cl)C3=C(C=C(C=C3)C)C

InChI

InChI=1S/C21H20Cl2N2O2/c1-4-5-18-12-20(25(24-18)19-7-6-13(2)8-14(19)3)27-21(26)15-9-16(22)11-17(23)10-15/h6-12H,4-5H2,1-3H3