3-(4-oxidanylidenebutanoylamino)propane-1-sulfonic acid

Systemtic Name: 3-(4-oxidanylidenebutanoylamino)propane-1-sulfonic acid Openeye Name: 3-(4-oxobutanoylamino)propane-1-sulfonic acid CAS Name: 3-(1,4-dioxobutylamino)-1-propanesulfonic acid IUPAC Name: 3-(4-oxobutanoylamino)propane-1-sulfonic acid Traditional Name: 3-(4-ketobutanoylamino)propane-1-sulfonic acid Formula: C7H13NO5S MolecularWeight: 223.24682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CNC(=O)CCC=O)CS(=O)(=O)O

Isomeric SMILES

C(CNC(=O)CCC=O)CS(=O)(=O)O

InChI

InChI=1S/C7H13NO5S/c9-5-1-3-7(10)8-4-2-6-14(11,12)13/h5H,1-4,6H2,(H,8,10)(H,11,12,13)