5,5-dimethyl-3-oxidanylidene-2-(phenylsulfonylmethyl)cyclohexen-1-olate

Systemtic Name: 5,5-dimethyl-3-oxidanylidene-2-(phenylsulfonylmethyl)cyclohexen-1-olate Openeye Name: 2-(benzenesulfonylmethyl)-5,5-dimethyl-3-oxo-cyclohexen-1-olate CAS Name: 2-(benzenesulfonylmethyl)-5,5-dimethyl-3-oxo-1-cyclohexenolate IUPAC Name: 2-(benzenesulfonylmethyl)-5,5-dimethyl-3-oxocyclohexen-1-olate Traditional Name: 2-(besylmethyl)-3-keto-5,5-dimethyl-cyclohexen-1-olate Formula: C15H17O4S- MolecularWeight: 293.35808

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)CS(=O)(=O)C2=CC=CC=C2)[O-])C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)CS(=O)(=O)C2=CC=CC=C2)[O-])C

InChI

InChI=1S/C15H18O4S/c1-15(2)8-13(16)12(14(17)9-15)10-20(18,19)11-6-4-3-5-7-11/h3-7,16H,8-10H2,1-2H3/p-1