butane-1-sulfonate; dimethyl(2-oxidanylideneheptyl)sulfanium

Systemtic Name: butane-1-sulfonate; dimethyl(2-oxidanylideneheptyl)sulfanium Openeye Name: butane-1-sulfonate; dimethyl(2-oxoheptyl)sulfonium CAS Name: 1-butanesulfonate; dimethyl(2-oxoheptyl)sulfonium IUPAC Name: butane-1-sulfonate; dimethyl(2-oxoheptyl)sulfanium Traditional Name: butane-1-sulfonate; 2-ketoheptyl(dimethyl)sulfonium Formula: C13H28O4S2 MolecularWeight: 312.48902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C[S+](C)C.CCCCS(=O)(=O)[O-]

Isomeric SMILES

CCCCCC(=O)C[S+](C)C.CCCCS(=O)(=O)[O-]

InChI

InChI=1S/C9H19OS.C4H10O3S/c1-4-5-6-7-9(10)8-11(2)3;1-2-3-4-8(5,6)7/h4-8H2,1-3H3;2-4H2,1H3,(H,5,6,7)/q+1;/p-1