[2-(4-decoxyphenyl)phenyl]iodanium; 4-methylbenzenesulfonate

Systemtic Name: [2-(4-decoxyphenyl)phenyl]iodanium; 4-methylbenzenesulfonate Openeye Name: [2-(4-decoxyphenyl)phenyl]iodonium; 4-methylbenzenesulfonate CAS Name: [2-(4-decoxyphenyl)phenyl]iodonium; 4-methylbenzenesulfonate IUPAC Name: [2-(4-decoxyphenyl)phenyl]iodanium; 4-methylbenzenesulfonate Traditional Name: [2-(4-decoxyphenyl)phenyl]iodonium tosylate Formula: C29H37IO4S MolecularWeight: 608.57115

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=CC=C2[IH+].CC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=CC=C2[IH+].CC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C22H30IO.C7H8O3S/c1-2-3-4-5-6-7-8-11-18-24-20-16-14-19(15-17-20)21-12-9-10-13-22(21)23;1-6-2-4-7(5-3-6)11(8,9)10/h9-10,12-17,23H,2-8,11,18H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1