potassium 5-(4-methylphenyl)sulfonylazanidylsulfonylbenzene-1,3-dicarboxylate

Systemtic Name: potassium 5-(4-methylphenyl)sulfonylazanidylsulfonylbenzene-1,3-dicarboxylate Openeye Name: potassium 5-(p-tolylsulfonylazanidylsulfonyl)benzene-1,3-dicarboxylate CAS Name: potassium 5-(4-methylphenyl)sulfonylazanidylsulfonylbenzene-1,3-dicarboxylate IUPAC Name: potassium 5-(4-methylphenyl)sulfonylazanidylsulfonylbenzene-1,3-dicarboxylate Traditional Name: potassium 5-tosylazanidylsulfonylisophthalate Formula: C15H10KNO8S2-2 MolecularWeight: 435.4701

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[N-]S(=O)(=O)C2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-].[K+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[N-]S(=O)(=O)C2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-].[K+]

InChI

InChI=1S/C15H12NO8S2.K/c1-9-2-4-12(5-3-9)25(21,22)16-26(23,24)13-7-10(14(17)18)6-11(8-13)15(19)20;/h2-8H,1H3,(H,17,18)(H,19,20);/q-1;+1/p-2