2-iodyl-3,5,6-trimethyl-benzenesulfonic acid

Systemtic Name: 2-iodyl-3,5,6-trimethyl-benzenesulfonic acid Openeye Name: 2-iodyl-3,5,6-trimethyl-benzenesulfonic acid CAS Name: 2-iodyl-3,5,6-trimethylbenzenesulfonic acid IUPAC Name: 2-iodyl-3,5,6-trimethylbenzenesulfonic acid Traditional Name: 2-iodyl-3,5,6-trimethyl-besylic acid Formula: C9H11IO5S MolecularWeight: 358.15011

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)O)I(=O)=O)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)O)I(=O)=O)C

InChI

InChI=1S/C9H11IO5S/c1-5-4-6(2)8(10(11)12)9(7(5)3)16(13,14)15/h4H,1-3H3,(H,13,14,15)