(4-cyclohexyl-3-methyl-2-oxidanylidene-butyl) benzenesulfonate

Systemtic Name: (4-cyclohexyl-3-methyl-2-oxidanylidene-butyl) benzenesulfonate Openeye Name: (4-cyclohexyl-3-methyl-2-oxo-butyl) benzenesulfonate CAS Name: benzenesulfonic acid (4-cyclohexyl-3-methyl-2-oxobutyl) ester IUPAC Name: (4-cyclohexyl-3-methyl-2-oxobutyl) benzenesulfonate Traditional Name: benzenesulfonic acid (4-cyclohexyl-2-keto-3-methyl-butyl) ester Formula: C17H24O4S MolecularWeight: 324.43506

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1CCCCC1)C(=O)COS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(CC1CCCCC1)C(=O)COS(=O)(=O)C2=CC=CC=C2

InChI

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