2-(disulfooxymethyl)butyl hydrogen sulfate

Systemtic Name: 2-(disulfooxymethyl)butyl hydrogen sulfate Openeye Name: 2-(disulfooxymethyl)butyl hydrogen sulfate CAS Name: sulfuric acid 2-(disulfooxymethyl)butyl ester IUPAC Name: 2-(disulfooxymethyl)butyl hydrogen sulfate Traditional Name: sulfuric acid 2-(disulfoxymethyl)butyl ester Formula: C5H12O12S3 MolecularWeight: 360.33658

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COS(=O)(=O)O)C(OS(=O)(=O)O)OS(=O)(=O)O

Isomeric SMILES

CCC(COS(=O)(=O)O)C(OS(=O)(=O)O)OS(=O)(=O)O

InChI

InChI=1S/C5H12O12S3/c1-2-4(3-15-18(6,7)8)5(16-19(9,10)11)17-20(12,13)14/h4-5H,2-3H2,1H3,(H,6,7,8)(H,9,10,11)(H,12,13,14)