sodium (4-hydroxyphenyl)methylsulfanyl sulfate

Systemtic Name: sodium (4-hydroxyphenyl)methylsulfanyl sulfate Openeye Name: sodium (4-hydroxyphenyl)methylsulfanyl sulfate CAS Name: sodium [(4-hydroxyphenyl)methylthio] sulfate IUPAC Name: sodium (4-hydroxyphenyl)methylsulfanyl sulfate Traditional Name: sodium [(4-hydroxybenzyl)thio] sulfate Formula: C7H7NaO5S2 MolecularWeight: 258.24725

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSOS(=O)(=O)[O-])O.[Na+]

Isomeric SMILES

C1=CC(=CC=C1CSOS(=O)(=O)[O-])O.[Na+]

InChI

InChI=1S/C7H8O5S2.Na/c8-7-3-1-6(2-4-7)5-13-12-14(9,10)11;/h1-4,8H,5H2,(H,9,10,11);/q;+1/p-1