(4-chlorophenyl)methylsulfanyl hydrogen sulfate

Systemtic Name: (4-chlorophenyl)methylsulfanyl hydrogen sulfate Openeye Name: (4-chlorophenyl)methylsulfanyl hydrogen sulfate CAS Name: (4-chlorophenyl)methanesulfenic acid sulfo ester IUPAC Name: (4-chlorophenyl)methylsulfanyl hydrogen sulfate Traditional Name: sulfuric acid [(4-chlorobenzyl)thio] ester Formula: C7H7ClO4S2 MolecularWeight: 254.71108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSOS(=O)(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1CSOS(=O)(=O)O)Cl

InChI

InChI=1S/C7H7ClO4S2/c8-7-3-1-6(2-4-7)5-13-12-14(9,10)11/h1-4H,5H2,(H,9,10,11)