4-chloranyl-2,6-bis(methylsulfonyl)pyrimidine-5-carboxylic acid

Systemtic Name: 4-chloranyl-2,6-bis(methylsulfonyl)pyrimidine-5-carboxylic acid Openeye Name: 4-chloro-2,6-bis(methylsulfonyl)pyrimidine-5-carboxylic acid CAS Name: 4-chloro-2,6-bis(methylsulfonyl)-5-pyrimidinecarboxylic acid IUPAC Name: 4-chloro-2,6-bis(methylsulfonyl)pyrimidine-5-carboxylic acid Traditional Name: 4-chloro-2,6-dimesyl-pyrimidine-5-carboxylic acid Formula: C7H7ClN2O6S2 MolecularWeight: 314.72328

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C(=NC(=N1)S(=O)(=O)C)Cl)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=C(C(=NC(=N1)S(=O)(=O)C)Cl)C(=O)O

InChI

InChI=1S/C7H7ClN2O6S2/c1-17(13,14)5-3(6(11)12)4(8)9-7(10-5)18(2,15)16/h1-2H3,(H,11,12)