(2-iodanyl-6-oxidanyl-phenyl) 4-methylbenzenesulfonate

Systemtic Name: (2-iodanyl-6-oxidanyl-phenyl) 4-methylbenzenesulfonate Openeye Name: (2-hydroxy-6-iodo-phenyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-hydroxy-6-iodophenyl) ester IUPAC Name: (2-hydroxy-6-iodophenyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-hydroxy-6-iodo-phenyl) ester Formula: C13H11IO4S MolecularWeight: 390.19351

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC=C2I)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC=C2I)O

InChI

InChI=1S/C13H11IO4S/c1-9-5-7-10(8-6-9)19(16,17)18-13-11(14)3-2-4-12(13)15/h2-8,15H,1H3