[2-(furan-2-yl)phenyl]iodanium; 4-methylbenzenesulfonate

Systemtic Name: [2-(furan-2-yl)phenyl]iodanium; 4-methylbenzenesulfonate Openeye Name: [2-(2-furyl)phenyl]iodonium; 4-methylbenzenesulfonate CAS Name: [2-(2-furanyl)phenyl]iodonium; 4-methylbenzenesulfonate IUPAC Name: [2-(furan-2-yl)phenyl]iodanium; 4-methylbenzenesulfonate Traditional Name: [2-(2-furyl)phenyl]iodonium tosylate Formula: C17H15IO4S MolecularWeight: 442.26807

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C(=C1)C2=CC=CO2)[IH+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C(=C1)C2=CC=CO2)[IH+]

InChI

InChI=1S/C10H8IO.C7H8O3S/c11-9-5-2-1-4-8(9)10-6-3-7-12-10;1-6-2-4-7(5-3-6)11(8,9)10/h1-7,11H;2-5H,1H3,(H,8,9,10)/q+1;/p-1