(3,5-dimethylphenyl)methylsulfanyl sulfate

Systemtic Name: (3,5-dimethylphenyl)methylsulfanyl sulfate Openeye Name: (3,5-dimethylphenyl)methylsulfanyl sulfate CAS Name: [(3,5-dimethylphenyl)methylthio] sulfate IUPAC Name: (3,5-dimethylphenyl)methylsulfanyl sulfate Traditional Name: [(3,5-dimethylbenzyl)thio] sulfate Formula: C9H11O4S2- MolecularWeight: 247.31124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12O4S2/c1-7-3-8(2)5-9(4-7)6-14-13-15(10,11)12/h3-5H,6H2,1-2H3,(H,10,11,12)/p-1