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

Systemtic Name: 2,6-bis(methylsulfonyl)pyrimidine-4-carboxylic acid Openeye Name: 2,6-bis(methylsulfonyl)pyrimidine-4-carboxylic acid CAS Name: 2,6-bis(methylsulfonyl)-4-pyrimidinecarboxylic acid IUPAC Name: 2,6-bis(methylsulfonyl)pyrimidine-4-carboxylic acid Traditional Name: 2,6-dimesylpyrimidine-4-carboxylic acid Formula: C7H8N2O6S2 MolecularWeight: 280.27822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8N2O6S2/c1-16(12,13)5-3-4(6(10)11)8-7(9-5)17(2,14)15/h3H,1-2H3,(H,10,11)