(3,3-dimethyl-2-oxidanylidene-butyl) 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate CAS Name: 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate Traditional Name: 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propionic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C16H20F3NO5S MolecularWeight: 395.39391

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)CCNS(=O)(=O)C1=CC=CC(=C1)C(F)(F)F

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)CCNS(=O)(=O)C1=CC=CC(=C1)C(F)(F)F

InChI

InChI=1S/C16H20F3NO5S/c1-15(2,3)13(21)10-25-14(22)7-8-20-26(23,24)12-6-4-5-11(9-12)16(17,18)19/h4-6,9,20H,7-8,10H2,1-3H3