butane-1-sulfonate; 2-oxidanylidenehexyl-di(propan-2-yl)sulfanium

Systemtic Name: butane-1-sulfonate; 2-oxidanylidenehexyl-di(propan-2-yl)sulfanium Openeye Name: butane-1-sulfonate; diisopropyl(2-oxohexyl)sulfonium CAS Name: 1-butanesulfonate; 2-oxohexyl-di(propan-2-yl)sulfonium IUPAC Name: butane-1-sulfonate; 2-oxohexyl-di(propan-2-yl)sulfanium Traditional Name: butane-1-sulfonate; diisopropyl(2-ketohexyl)sulfonium Formula: C16H34O4S2 MolecularWeight: 354.56876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H25OS.C4H10O3S/c1-6-7-8-12(13)9-14(10(2)3)11(4)5;1-2-3-4-8(5,6)7/h10-11H,6-9H2,1-5H3;2-4H2,1H3,(H,5,6,7)/q+1;/p-1