butane-1-sulfonate; 1-(1,4-dithian-1-ium-1-yl)butan-2-one

Systemtic Name: butane-1-sulfonate; 1-(1,4-dithian-1-ium-1-yl)butan-2-one Openeye Name: butane-1-sulfonate; 1-(1,4-dithian-1-ium-1-yl)butan-2-one CAS Name: 1-butanesulfonate; 1-(1,4-dithian-1-ium-1-yl)-2-butanone IUPAC Name: butane-1-sulfonate; 1-(1,4-dithian-1-ium-1-yl)butan-2-one Traditional Name: butane-1-sulfonate; 1-(1,4-dithian-1-ium-1-yl)butan-2-one Formula: C12H24O4S3 MolecularWeight: 328.51156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)[O-].CCC(=O)C[S+]1CCSCC1

Isomeric SMILES

CCCCS(=O)(=O)[O-].CCC(=O)C[S+]1CCSCC1

InChI

InChI=1S/C8H15OS2.C4H10O3S/c1-2-8(9)7-11-5-3-10-4-6-11;1-2-3-4-8(5,6)7/h2-7H2,1H3;2-4H2,1H3,(H,5,6,7)/q+1;/p-1