(4-cyclohexyl-2-oxidanylidene-pentyl) benzenesulfonate

Systemtic Name: (4-cyclohexyl-2-oxidanylidene-pentyl) benzenesulfonate Openeye Name: (4-cyclohexyl-2-oxo-pentyl) benzenesulfonate CAS Name: benzenesulfonic acid (4-cyclohexyl-2-oxopentyl) ester IUPAC Name: (4-cyclohexyl-2-oxopentyl) benzenesulfonate Traditional Name: benzenesulfonic acid (4-cyclohexyl-2-keto-pentyl) ester Formula: C17H24O4S MolecularWeight: 324.43506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)COS(=O)(=O)C1=CC=CC=C1)C2CCCCC2

Isomeric SMILES

CC(CC(=O)COS(=O)(=O)C1=CC=CC=C1)C2CCCCC2

InChI

InChI=1S/C17H24O4S/c1-14(15-8-4-2-5-9-15)12-16(18)13-21-22(19,20)17-10-6-3-7-11-17/h3,6-7,10-11,14-15H,2,4-5,8-9,12-13H2,1H3