2-oxidanylideneoctyl benzenesulfonate

Systemtic Name: 2-oxidanylideneoctyl benzenesulfonate Openeye Name: 2-oxooctyl benzenesulfonate CAS Name: benzenesulfonic acid 2-oxooctyl ester IUPAC Name: 2-oxooctyl benzenesulfonate Traditional Name: benzenesulfonic acid 2-ketooctyl ester Formula: C14H20O4S MolecularWeight: 284.3712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)COS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCC(=O)COS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C14H20O4S/c1-2-3-4-6-9-13(15)12-18-19(16,17)14-10-7-5-8-11-14/h5,7-8,10-11H,2-4,6,9,12H2,1H3