sodium (4-methylphenyl)methylsulfanyl sulfate

Systemtic Name: sodium (4-methylphenyl)methylsulfanyl sulfate Openeye Name: sodium p-tolylmethylsulfanyl sulfate CAS Name: sodium [(4-methylphenyl)methylthio] sulfate IUPAC Name: sodium (4-methylphenyl)methylsulfanyl sulfate Traditional Name: sodium [(4-methylbenzyl)thio] sulfate Formula: C8H9NaO4S2 MolecularWeight: 256.27443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSOS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)CSOS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C8H10O4S2.Na/c1-7-2-4-8(5-3-7)6-13-12-14(9,10)11;/h2-5H,6H2,1H3,(H,9,10,11);/q;+1/p-1