3-[[(2R)-4-methyl-1-oxidanidyl-1-oxidanylidene-pentan-2-yl]sulfamoyl]benzoate

Systemtic Name: 3-[[(2R)-4-methyl-1-oxidanidyl-1-oxidanylidene-pentan-2-yl]sulfamoyl]benzoate Openeye Name: 3-[[(1R)-1-carboxylato-3-methyl-butyl]sulfamoyl]benzoate CAS Name: 3-[[(2R)-4-methyl-1-oxido-1-oxopentan-2-yl]sulfamoyl]benzoate IUPAC Name: 3-[[(2R)-4-methyl-1-oxido-1-oxopentan-2-yl]sulfamoyl]benzoate Traditional Name: 3-[[(1R)-1-carboxylato-3-methyl-butyl]sulfamoyl]benzoate Formula: C13H15NO6S-2 MolecularWeight: 313.3263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NS(=O)(=O)C1=CC=CC(=C1)C(=O)[O-]

Isomeric SMILES

CC(C)C[C@H](C(=O)[O-])NS(=O)(=O)C1=CC=CC(=C1)C(=O)[O-]

InChI

InChI=1S/C13H17NO6S/c1-8(2)6-11(13(17)18)14-21(19,20)10-5-3-4-9(7-10)12(15)16/h3-5,7-8,11,14H,6H2,1-2H3,(H,15,16)(H,17,18)/p-2/t11-/m1/s1