4-[2,4,6-tris(oxidanylidene)-1,3-diazinan-1-yl]benzenesulfonic acid

Systemtic Name: 4-[2,4,6-tris(oxidanylidene)-1,3-diazinan-1-yl]benzenesulfonic acid Openeye Name: 4-(2,4,6-trioxohexahydropyrimidin-1-yl)benzenesulfonic acid CAS Name: 4-(2,4,6-trioxo-1,3-diazinan-1-yl)benzenesulfonic acid IUPAC Name: 4-(2,4,6-trioxo-1,3-diazinan-1-yl)benzenesulfonic acid Traditional Name: 4-(2,4,6-triketohexahydropyrimidin-1-yl)besylic acid Formula: C10H8N2O6S MolecularWeight: 284.24532

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)S(=O)(=O)O

Isomeric SMILES

C1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)S(=O)(=O)O

InChI

InChI=1S/C10H8N2O6S/c13-8-5-9(14)12(10(15)11-8)6-1-3-7(4-2-6)19(16,17)18/h1-4H,5H2,(H,11,13,15)(H,16,17,18)