2,3,4,5-tetrakis(chloranyl)-6-(pyrimidin-2-ylcarbamoyl)benzoic acid

Systemtic Name: 2,3,4,5-tetrakis(chloranyl)-6-(pyrimidin-2-ylcarbamoyl)benzoic acid Openeye Name: 2,3,4,5-tetrachloro-6-(pyrimidin-2-ylcarbamoyl)benzoic acid CAS Name: 2,3,4,5-tetrachloro-6-[oxo-(2-pyrimidinylamino)methyl]benzoic acid IUPAC Name: 2,3,4,5-tetrachloro-6-(pyrimidin-2-ylcarbamoyl)benzoic acid Traditional Name: 2,3,4,5-tetrachloro-6-(2-pyrimidylcarbamoyl)benzoic acid Formula: C12H5Cl4N3O3 MolecularWeight: 380.9984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NC(=O)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)C(=O)O

Isomeric SMILES

C1=CN=C(N=C1)NC(=O)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)C(=O)O

InChI

InChI=1S/C12H5Cl4N3O3/c13-6-4(10(20)19-12-17-2-1-3-18-12)5(11(21)22)7(14)9(16)8(6)15/h1-3H,(H,21,22)(H,17,18,19,20)