tripotassium 5-sulfonatobenzene-1,3-dicarboxylate

Systemtic Name: tripotassium 5-sulfonatobenzene-1,3-dicarboxylate Openeye Name: tripotassium 5-sulfonatobenzene-1,3-dicarboxylate CAS Name: tripotassium 5-sulfonatobenzene-1,3-dicarboxylate IUPAC Name: tripotassium 5-sulfonatobenzene-1,3-dicarboxylate Traditional Name: tripotassium 5-sulfonatoisophthalate Formula: C8H3K3O7S MolecularWeight: 360.46512

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(=O)[O-])S(=O)(=O)[O-])C(=O)[O-].[K+].[K+].[K+]

Isomeric SMILES

C1=C(C=C(C=C1C(=O)[O-])S(=O)(=O)[O-])C(=O)[O-].[K+].[K+].[K+]

InChI

InChI=1S/C8H6O7S.3K/c9-7(10)4-1-5(8(11)12)3-6(2-4)16(13,14)15;;;/h1-3H,(H,9,10)(H,11,12)(H,13,14,15);;;/q;3*+1/p-3