bis[(4-methylphenyl)carbonyl]iodanium; 4-methylbenzenesulfonate

Systemtic Name: bis[(4-methylphenyl)carbonyl]iodanium; 4-methylbenzenesulfonate Openeye Name: bis(4-methylbenzoyl)iodonium; 4-methylbenzenesulfonate CAS Name: bis[(4-methylphenyl)-oxomethyl]iodonium; 4-methylbenzenesulfonate IUPAC Name: bis(4-methylbenzoyl)iodanium; 4-methylbenzenesulfonate Traditional Name: bis(p-toluoyl)iodonium tosylate Formula: C23H21IO5S MolecularWeight: 536.37931

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14IO2.C7H8O3S/c1-11-3-7-13(8-4-11)15(18)17-16(19)14-9-5-12(2)6-10-14;1-6-2-4-7(5-3-6)11(8,9)10/h3-10H,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1