4-oxidanylideneheptane-2-sulfonate

Systemtic Name: 4-oxidanylideneheptane-2-sulfonate Openeye Name: 4-oxoheptane-2-sulfonate CAS Name: 4-oxo-2-heptanesulfonate IUPAC Name: 4-oxoheptane-2-sulfonate Traditional Name: 4-ketoheptane-2-sulfonate Formula: C7H13O4S- MolecularWeight: 193.24072

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)CC(C)S(=O)(=O)[O-]

Isomeric SMILES

CCCC(=O)CC(C)S(=O)(=O)[O-]

InChI

InChI=1S/C7H14O4S/c1-3-4-7(8)5-6(2)12(9,10)11/h6H,3-5H2,1-2H3,(H,9,10,11)/p-1