(4-oxidanylidenecyclooctyl) 4-methylbenzenesulfonate

Systemtic Name: (4-oxidanylidenecyclooctyl) 4-methylbenzenesulfonate Openeye Name: (4-oxocyclooctyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (4-oxocyclooctyl) ester IUPAC Name: (4-oxocyclooctyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-ketocyclooctyl) ester Formula: C15H20O4S MolecularWeight: 296.3819

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CCCCC(=O)CC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CCCCC(=O)CC2

InChI

InChI=1S/C15H20O4S/c1-12-6-10-15(11-7-12)20(17,18)19-14-5-3-2-4-13(16)8-9-14/h6-7,10-11,14H,2-5,8-9H2,1H3