potassium 5-methyl-3-nitro-2-oxidanyl-benzenesulfonate

Systemtic Name: potassium 5-methyl-3-nitro-2-oxidanyl-benzenesulfonate Openeye Name: potassium 2-hydroxy-5-methyl-3-nitro-benzenesulfonate CAS Name: potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate IUPAC Name: potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate Traditional Name: potassium 2-hydroxy-5-methyl-3-nitro-besylate Formula: C7H6KNO6S MolecularWeight: 271.28894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H7NO6S.K/c1-4-2-5(8(10)11)7(9)6(3-4)15(12,13)14;/h2-3,9H,1H3,(H,12,13,14);/q;+1/p-1