bis[(4-methylphenyl)carbonyl]iodanium; 2-dodecylbenzenesulfonate

Systemtic Name: bis[(4-methylphenyl)carbonyl]iodanium; 2-dodecylbenzenesulfonate Openeye Name: bis(4-methylbenzoyl)iodonium; 2-dodecylbenzenesulfonate CAS Name: bis[(4-methylphenyl)-oxomethyl]iodonium; 2-dodecylbenzenesulfonate IUPAC Name: bis(4-methylbenzoyl)iodanium; 2-dodecylbenzenesulfonate Traditional Name: bis(p-toluoyl)iodonium; 2-laurylbesylate Formula: C34H43IO5S MolecularWeight: 690.67169

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].CC1=CC=C(C=C1)C(=O)[I+]C(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].CC1=CC=C(C=C1)C(=O)[I+]C(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H30O3S.C16H14IO2/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21;1-11-3-7-13(8-4-11)15(18)17-16(19)14-9-5-12(2)6-10-14/h12-13,15-16H,2-11,14H2,1H3,(H,19,20,21);3-10H,1-2H3/q;+1/p-1