sodium (2-methyl-1-oxidanylidene-1-phenyl-propan-2-yl)sulfanyl sulfate

Systemtic Name: sodium (2-methyl-1-oxidanylidene-1-phenyl-propan-2-yl)sulfanyl sulfate Openeye Name: sodium (1,1-dimethyl-2-oxo-2-phenyl-ethyl)sulfanyl sulfate CAS Name: sodium [(2-methyl-1-oxo-1-phenylpropan-2-yl)thio] sulfate IUPAC Name: sodium (2-methyl-1-oxo-1-phenylpropan-2-yl)sulfanyl sulfate Traditional Name: sodium [(2-keto-1,1-dimethyl-2-phenyl-ethyl)thio] sulfate Formula: C10H11NaO5S2 MolecularWeight: 298.31111

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C1=CC=CC=C1)SOS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC(C)(C(=O)C1=CC=CC=C1)SOS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C10H12O5S2.Na/c1-10(2,16-15-17(12,13)14)9(11)8-6-4-3-5-7-8;/h3-7H,1-2H3,(H,12,13,14);/q;+1/p-1