3-azanyl-2-butanoyloxy-propane-1-sulfonic acid

Systemtic Name: 3-azanyl-2-butanoyloxy-propane-1-sulfonic acid Openeye Name: 3-amino-2-butanoyloxy-propane-1-sulfonic acid CAS Name: 3-amino-2-(1-oxobutoxy)-1-propanesulfonic acid IUPAC Name: 3-amino-2-butanoyloxypropane-1-sulfonic acid Traditional Name: 3-amino-2-butyryloxy-propane-1-sulfonic acid Formula: C7H15NO5S MolecularWeight: 225.2627

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(CN)CS(=O)(=O)O

Isomeric SMILES

CCCC(=O)OC(CN)CS(=O)(=O)O

InChI

InChI=1S/C7H15NO5S/c1-2-3-7(9)13-6(4-8)5-14(10,11)12/h6H,2-5,8H2,1H3,(H,10,11,12)