1,3-dimethyl-5-[2,4,5-tris(chloranyl)phenoxy]pyrazole-4-carboxylate

Systemtic Name: 1,3-dimethyl-5-[2,4,5-tris(chloranyl)phenoxy]pyrazole-4-carboxylate Openeye Name: 1,3-dimethyl-5-(2,4,5-trichlorophenoxy)pyrazole-4-carboxylate CAS Name: 1,3-dimethyl-5-(2,4,5-trichlorophenoxy)-4-pyrazolecarboxylate IUPAC Name: 1,3-dimethyl-5-(2,4,5-trichlorophenoxy)pyrazole-4-carboxylate Traditional Name: 1,3-dimethyl-5-(2,4,5-trichlorophenoxy)pyrazole-4-carboxylate Formula: C12H8Cl3N2O3- MolecularWeight: 334.56252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)[O-])OC2=CC(=C(C=C2Cl)Cl)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)[O-])OC2=CC(=C(C=C2Cl)Cl)Cl)C

InChI

InChI=1S/C12H9Cl3N2O3/c1-5-10(12(18)19)11(17(2)16-5)20-9-4-7(14)6(13)3-8(9)15/h3-4H,1-2H3,(H,18,19)/p-1