N-(2-iodanylethyl)-4-methyl-N-[(2R)-1-oxidanyl-3-oxidanylidene-butan-2-yl]benzenesulfonamide

Systemtic Name: N-(2-iodanylethyl)-4-methyl-N-[(2R)-1-oxidanyl-3-oxidanylidene-butan-2-yl]benzenesulfonamide Openeye Name: N-[(1R)-1-(hydroxymethyl)-2-oxo-propyl]-N-(2-iodoethyl)-4-methyl-benzenesulfonamide CAS Name: N-[(2R)-1-hydroxy-3-oxobutan-2-yl]-N-(2-iodoethyl)-4-methylbenzenesulfonamide IUPAC Name: N-[(2R)-1-hydroxy-3-oxobutan-2-yl]-N-(2-iodoethyl)-4-methylbenzenesulfonamide Traditional Name: N-(2-iodoethyl)-N-[(1R)-2-keto-1-methylol-propyl]-4-methyl-benzenesulfonamide Formula: C13H18INO4S MolecularWeight: 411.25579

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCI)C(CO)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCI)[C@H](CO)C(=O)C

InChI

InChI=1S/C13H18INO4S/c1-10-3-5-12(6-4-10)20(18,19)15(8-7-14)13(9-16)11(2)17/h3-6,13,16H,7-9H2,1-2H3/t13-/m1/s1