sodium 3-[[4,6-bis(oxidanylidene)-1H-1,3,5-triazin-2-yl]amino]benzenesulfonate

Systemtic Name: sodium 3-[[4,6-bis(oxidanylidene)-1H-1,3,5-triazin-2-yl]amino]benzenesulfonate Openeye Name: sodium 3-[(4,6-dioxo-1H-1,3,5-triazin-2-yl)amino]benzenesulfonate CAS Name: sodium 3-[(4,6-dioxo-1H-1,3,5-triazin-2-yl)amino]benzenesulfonate IUPAC Name: sodium 3-[(4,6-dioxo-1H-1,3,5-triazin-2-yl)amino]benzenesulfonate Traditional Name: sodium 3-[(4,6-diketo-1H-s-triazin-2-yl)amino]besylate Formula: C9H7N4NaO5S MolecularWeight: 306.23045

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)[O-])NC2=NC(=O)NC(=O)N2.[Na+]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)[O-])NC2=NC(=O)NC(=O)N2.[Na+]

InChI

InChI=1S/C9H8N4O5S.Na/c14-8-11-7(12-9(15)13-8)10-5-2-1-3-6(4-5)19(16,17)18;/h1-4H,(H,16,17,18)(H3,10,11,12,13,14,15);/q;+1/p-1