2-[1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]sulfonylethanoic acid

Systemtic Name: 2-[1-(tert-butylamino)-1-oxidanylidene-propan-2-yl]sulfonylethanoic acid Openeye Name: 2-[2-(tert-butylamino)-1-methyl-2-oxo-ethyl]sulfonylacetic acid CAS Name: 2-[1-(tert-butylamino)-1-oxopropan-2-yl]sulfonylacetic acid IUPAC Name: 2-[1-(tert-butylamino)-1-oxopropan-2-yl]sulfonylacetic acid Traditional Name: 2-[2-(tert-butylamino)-2-keto-1-methyl-ethyl]sulfonylacetic acid Formula: C9H17NO5S MolecularWeight: 251.29998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)S(=O)(=O)CC(=O)O

Isomeric SMILES

CC(C(=O)NC(C)(C)C)S(=O)(=O)CC(=O)O

InChI

InChI=1S/C9H17NO5S/c1-6(8(13)10-9(2,3)4)16(14,15)5-7(11)12/h6H,5H2,1-4H3,(H,10,13)(H,11,12)