[4-(2,4,4-trimethylpentan-2-yl)phenyl]methylsulfanyl hydrogen sulfate

Systemtic Name: [4-(2,4,4-trimethylpentan-2-yl)phenyl]methylsulfanyl hydrogen sulfate Openeye Name: [4-(1,1,3,3-tetramethylbutyl)phenyl]methylsulfanyl hydrogen sulfate CAS Name: [4-(2,4,4-trimethylpentan-2-yl)phenyl]methanesulfenic acid sulfo ester IUPAC Name: [4-(2,4,4-trimethylpentan-2-yl)phenyl]methylsulfanyl hydrogen sulfate Traditional Name: sulfuric acid [[4-(1,1,3,3-tetramethylbutyl)benzyl]thio] ester Formula: C15H24O4S2 MolecularWeight: 332.47866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24O4S2/c1-14(2,3)11-15(4,5)13-8-6-12(7-9-13)10-20-19-21(16,17)18/h6-9H,10-11H2,1-5H3,(H,16,17,18)