(3,5-ditert-butylphenyl)methylsulfanyl hydrogen sulfate

Systemtic Name: (3,5-ditert-butylphenyl)methylsulfanyl hydrogen sulfate Openeye Name: (3,5-ditert-butylphenyl)methylsulfanyl hydrogen sulfate CAS Name: (3,5-ditert-butylphenyl)methanesulfenic acid sulfo ester IUPAC Name: (3,5-ditert-butylphenyl)methylsulfanyl hydrogen sulfate Traditional Name: sulfuric acid [(3,5-ditert-butylbenzyl)thio] ester Formula: C15H24O4S2 MolecularWeight: 332.47866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)CSOS(=O)(=O)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)CSOS(=O)(=O)O)C(C)(C)C

InChI

InChI=1S/C15H24O4S2/c1-14(2,3)12-7-11(10-20-19-21(16,17)18)8-13(9-12)15(4,5)6/h7-9H,10H2,1-6H3,(H,16,17,18)