2,2-dimethylpropyl butane-1-sulfonate

Systemtic Name: 2,2-dimethylpropyl butane-1-sulfonate Openeye Name: 2,2-dimethylpropyl butane-1-sulfonate CAS Name: 1-butanesulfonic acid IUPAC Name: 2,2-dimethylpropyl butane-1-sulfonate Traditional Name: butane-1-sulfonic acid neopentyl ester Formula: C9H20O3S MolecularWeight: 208.3183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)OCC(C)(C)C

Isomeric SMILES

CCCCS(=O)(=O)OCC(C)(C)C

InChI

InChI=1S/C9H20O3S/c1-5-6-7-13(10,11)12-8-9(2,3)4/h5-8H2,1-4H3