3-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfonylpropanoic acid

Systemtic Name: 3-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfonylpropanoic acid Openeye Name: 3-[2-(tert-butylamino)-2-oxo-ethyl]sulfonylpropanoic acid CAS Name: 3-[2-(tert-butylamino)-2-oxoethyl]sulfonylpropanoic acid IUPAC Name: 3-[2-(tert-butylamino)-2-oxoethyl]sulfonylpropanoic acid Traditional Name: 3-[2-(tert-butylamino)-2-keto-ethyl]sulfonylpropionic acid Formula: C9H17NO5S MolecularWeight: 251.29998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CS(=O)(=O)CCC(=O)O

Isomeric SMILES

CC(C)(C)NC(=O)CS(=O)(=O)CCC(=O)O

InChI

InChI=1S/C9H17NO5S/c1-9(2,3)10-7(11)6-16(14,15)5-4-8(12)13/h4-6H2,1-3H3,(H,10,11)(H,12,13)