potassium 4-methyl-2-nitro-benzenesulfonate

Systemtic Name: potassium 4-methyl-2-nitro-benzenesulfonate Openeye Name: potassium 4-methyl-2-nitro-benzenesulfonate CAS Name: potassium 4-methyl-2-nitrobenzenesulfonate IUPAC Name: potassium 4-methyl-2-nitrobenzenesulfonate Traditional Name: potassium 4-methyl-2-nitro-besylate Formula: C7H6KNO5S MolecularWeight: 255.28954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H7NO5S.K/c1-5-2-3-7(14(11,12)13)6(4-5)8(9)10;/h2-4H,1H3,(H,11,12,13);/q;+1/p-1