Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID50210359

Structure

InChI Key VUOQDVJCGIRTJN-UHFFFAOYSA-N
Smiles O=S(=O)([O-])OCC[N+]=1C=CC=CC1
InChI
InChI=1/C7H9NO4S/c9-13(10,11)12-7-6-8-4-2-1-3-5-8/h1-5H,6-7H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C7H10NO4S

Cross References

Resources Reference
CAS NUMBER 6142-30-9
NORMAN SUSDAT
PubChem 80241