butane-1-sulfonate; 1-(1,4-oxathian-4-ium-4-yl)propan-2-one

Systemtic Name: butane-1-sulfonate; 1-(1,4-oxathian-4-ium-4-yl)propan-2-one Openeye Name: butane-1-sulfonate; 1-(1,4-oxathian-4-ium-4-yl)propan-2-one CAS Name: 1-butanesulfonate; 1-(1,4-oxathian-4-ium-4-yl)-2-propanone IUPAC Name: butane-1-sulfonate; 1-(1,4-oxathian-4-ium-4-yl)propan-2-one Traditional Name: butane-1-sulfonate; 1-(1,4-oxathian-4-ium-4-yl)acetone Formula: C11H22O5S2 MolecularWeight: 298.41938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)[O-].CC(=O)C[S+]1CCOCC1

Isomeric SMILES

CCCCS(=O)(=O)[O-].CC(=O)C[S+]1CCOCC1

InChI

InChI=1S/C7H13O2S.C4H10O3S/c1-7(8)6-10-4-2-9-3-5-10;1-2-3-4-8(5,6)7/h2-6H2,1H3;2-4H2,1H3,(H,5,6,7)/q+1;/p-1