(2,6-dimethyl-4-oxidanylidene-pyran-3-yl)iodanium; 4-methylbenzenesulfonate

Systemtic Name: (2,6-dimethyl-4-oxidanylidene-pyran-3-yl)iodanium; 4-methylbenzenesulfonate Openeye Name: (2,6-dimethyl-4-oxo-pyran-3-yl)iodonium; 4-methylbenzenesulfonate CAS Name: (2,6-dimethyl-4-oxo-3-pyranyl)iodonium; 4-methylbenzenesulfonate IUPAC Name: (2,6-dimethyl-4-oxopyran-3-yl)iodanium; 4-methylbenzenesulfonate Traditional Name: (4-keto-2,6-dimethyl-pyran-3-yl)iodonium tosylate Formula: C14H15IO5S MolecularWeight: 422.23537

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC(=O)C(=C(O1)C)[IH+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC(=O)C(=C(O1)C)[IH+]

InChI

InChI=1S/C7H8IO2.C7H8O3S/c1-4-3-6(9)7(8)5(2)10-4;1-6-2-4-7(5-3-6)11(8,9)10/h3,8H,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1