5-tert-butyl-1-[2,4,6-tris(chloranyl)phenyl]pyrazole-3-carboxylate

Systemtic Name: 5-tert-butyl-1-[2,4,6-tris(chloranyl)phenyl]pyrazole-3-carboxylate Openeye Name: 5-tert-butyl-1-(2,4,6-trichlorophenyl)pyrazole-3-carboxylate CAS Name: 5-tert-butyl-1-(2,4,6-trichlorophenyl)-3-pyrazolecarboxylate IUPAC Name: 5-tert-butyl-1-(2,4,6-trichlorophenyl)pyrazole-3-carboxylate Traditional Name: 5-tert-butyl-1-(2,4,6-trichlorophenyl)pyrazole-3-carboxylate Formula: C14H12Cl3N2O2- MolecularWeight: 346.61628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1C2=C(C=C(C=C2Cl)Cl)Cl)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=NN1C2=C(C=C(C=C2Cl)Cl)Cl)C(=O)[O-]

InChI

InChI=1S/C14H13Cl3N2O2/c1-14(2,3)11-6-10(13(20)21)18-19(11)12-8(16)4-7(15)5-9(12)17/h4-6H,1-3H3,(H,20,21)/p-1