2-(tert-butylcarbamoyl)-3-methylsulfonyloxy-benzoic acid

Systemtic Name: 2-(tert-butylcarbamoyl)-3-methylsulfonyloxy-benzoic acid Openeye Name: 2-(tert-butylcarbamoyl)-3-methylsulfonyloxy-benzoic acid CAS Name: 2-[(tert-butylamino)-oxomethyl]-3-methylsulfonyloxybenzoic acid IUPAC Name: 2-(tert-butylcarbamoyl)-3-methylsulfonyloxybenzoic acid Traditional Name: 2-(tert-butylcarbamoyl)-3-methylsulfonyloxy-benzoic acid Formula: C13H17NO6S MolecularWeight: 315.34218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=C(C=CC=C1OS(=O)(=O)C)C(=O)O

Isomeric SMILES

CC(C)(C)NC(=O)C1=C(C=CC=C1OS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C13H17NO6S/c1-13(2,3)14-11(15)10-8(12(16)17)6-5-7-9(10)20-21(4,18)19/h5-7H,1-4H3,(H,14,15)(H,16,17)